SCHEMBL940109

SCHEMBL940109

CCOC(=O)Nc1ccccc1Cc1ccccc1NC(=O)OCC

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.62
HPGD P15428 2/20 0.62
CYP1A2 P05177 1/20 0.56
CYP2C9 P11712 1/20 0.56
CYP2C19 P33261 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.54
MEN1 O00255 1/20 0.54
KMT2A Q03164 1/20 0.54
NLRP3 Q96P20 4/20 0.51
MAPT P10636 2/20 0.51
L3MBTL1 Q9Y468 2/20 0.51
NPC1 O15118 2/20 0.50
RAB9A P51151 2/20 0.50
CRHBP P24387 1/20 0.50
CRHR2 Q13324 1/20 0.50
MAOB P27338 1/20 0.50
LMNA P02545 1/20 0.49
MAPK1 P28482 1/20 0.49
HSD17B10 Q99714 1/20 0.49
KDM4E B2RXH2 1/20 0.49

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL1400826 0.91 ALDH1A1 (0.64) ALDH1A1HPGDCYP1A2CYP2C9CYP2C19
SCHEMBL5006073 0.91 L3MBTL1 (0.61) ALDH1A1HPGDCYP1A2CYP2C9CYP2C19
SCHEMBL11306455 0.90 ALDH1A1 (0.62) ALDH1A1HPGDCYP1A2CYP2C9CYP2C19
SCHEMBL28401182 0.87 ALDH1A1 (0.72) ALDH1A1HPGDCYP1A2CYP2C9CYP2C19
SCHEMBL28451035 0.87 ALDH1A1 (0.59) ALDH1A1HPGDCYP1A2CYP2C9CYP2C19
SCHEMBL1839320 0.87 SMN1; SMN2 (0.54) ALDH1A1HPGDCYP1A2CYP2C19SMN1; SMN2
SCHEMBL28834605 0.87 ALDH1A1 (0.59) ALDH1A1HPGDCYP1A2CYP2C9CYP2C19
SCHEMBL7788545 0.87 RAB9A (0.56) ALDH1A1HPGDCYP1A2CYP2C9CYP2C19
SCHEMBL18231364 0.85 ALDH1A1 (0.57) ALDH1A1HPGDCYP1A2CYP2C9CYP2C19
SCHEMBL8867010 0.85 ALDH1A1 (0.57) ALDH1A1HPGDCYP1A2CYP2C9CYP2C19

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8846971-B2 Metal carbamates formed from diaminophenylmethane BASF SE (DE) 2014-09-30 US claimed
US-20130281727-A1 METAL CARBAMATES FORMED FROM DIAMINOPHENYLMETHANE BASF SE (DE) 2013-10-24 US claimed
EP-2265572-B1 METAL CARBAMATES FORMED FROM DIAMINOPHENYLMETHANE BASF SE (DE) 2012-07-18 EP claimed
US-20110015424-A1 METAL CARBAMATES FORMED FROM DIAMINOPHENYLMETHANE BASF SE (DE) 2011-01-20 US claimed
EP-2265572-A1 METAL CARBAMATES FORMED FROM DIAMINOPHENYLMETHANE BASF SE (DE) 2010-12-29 EP claimed
WO-2009115537-A1 METAL CARBAMATES FORMED FROM DIAMINOPHENYLMETHANE BASF SE (DE) 2009-09-24 WO claimed
US-4567287-A Preparation of carbamates from organic carbonates and aromatic ureas THE UPJOHN CO. (US) 1986-01-28 US claimed
EP-2752405-B1 METHOD FOR PREPARING POLYMETHYLENE POLYPHENYL POLYAMINO FORMATE INST PROCESS ENG CAS (CN) 2018-08-22 EP disclosed
EP-2322504-B9 PROCESS FOR THE PREPARATION OF N-SUBSTITUTED CARBAMIC ACID ESTER AND PROCESS FOR THE PREPARATION OF ISOCYANATE USING THE N-SUBSTITUTED CARBAMIC ACID ESTER ASAHI CHEMICAL IND (JP) 2017-09-06 EP disclosed
EP-2322504-B1 PROCESS FOR THE PREPARATION OF N-SUBSTITUTED CARBAMIC ACID ESTER AND PROCESS FOR THE PREPARATION OF ISOCYANATE USING THE N-SUBSTITUTED CARBAMIC ACID ESTER ASAHI CHEMICAL IND (JP) 2016-09-28 EP disclosed
US-9249090-B2 N-substituted carbamic acid ester production method and isocyanate production method using the N-substituted carbamic acid ester ASAHI KASEI CHEMICALS CORPORATION (JP) 2016-02-02 US disclosed
US-9062161-B2 Method for preparing polymethylene polyphenyl polycarbamate INSTITUTE OF PROCESS ENGINEERING, CHINESE ACADEMY OF SCIENCES (CN) 2015-06-23 US disclosed
US-20150038742-A1 N-Substituted Carbamic Acid Ester Production Method and Isocyanate Production Method Using the N-Substituted Carbamic Acid Ester ASAHI KASEI CHEMICALS CORPORATION (JP) 2015-02-05 US disclosed
US-20140316100-A1 METHOD FOR PREPARING POLYMETHYLENE POLYPHENYL POLYCARBAMATE INSTITUTE OF PROCESS ENGINEERING, CHINESE ACADEMY OF SCIENCES (CN) 2014-10-23 US disclosed
EP-2752405-A1 METHOD FOR PREPARING POLYMETHYLENE POLYPHENYL POLYAMINO FORMATE Institute of Process Engineering, Chinese Academy of Sciences (CN) 2014-07-09 EP disclosed
US-20110160476-A1 N-Substituted Carbamic Acid Ester Production Method and Isocyanate Production Method Using the N-Substituted Carbamic Acid Ester ASAHI KASEI CHEMICALS CORPORATION (JP) 2011-06-30 US disclosed
EP-2322504-A1 PROCESS FOR THE PREPARATION OF N-SUBSTITUTED CARBAMIC ACID ESTER AND PROCESS FOR THE PREPARATION OF ISOCYANATE USING THE N-SUBSTITUTED CARBAMIC ACID ESTER Asahi Kasei Chemicals Corporation (JP) 2011-05-18 EP disclosed
EP-0881213-B1 Process for the synthesis of aromatic urethanes MINI RICERCA SCIENT TECNOLOG (IT) 2001-09-19 EP disclosed
US-6034265-A REACTING A CARBONATE WITH AROMATIC AMINE MINISTERO DELL'UNIVERSITA E DELLA RICERCA SCIENTIFICA E TECNOLOGICA (IT) 2000-03-07 US disclosed
EP-0881213-A2 Process for the synthesis of aromatic urethanes MINISTERO DELL' UNIVERSITA' E DELLA RICERCA SCIENTIFICA E TECNOLOGICA (IT) 1998-12-02 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110015424-A1 METAL CARBAMATES FORMED FROM DIAMINOPHENYLMETHANE ARG1, PRMT1, PRMT3 ALDH1A1 1450/4885HPGD 4268/4885CYP1A2 1183/4885
US-20110160476-A1 N-Substituted Carbamic Acid Ester Production Method and Isocyanate Production Method Using the N-Substituted Carbamic Acid Ester ALKBH3, CPS1, APEH ALDH1A1 574/4885HPGD 703/4885CYP1A2 121/4885
US-20150038742-A1 N-Substituted Carbamic Acid Ester Production Method and Isocyanate Production Method Using the N-Substituted Carbamic Acid Ester ALKBH3, CPS1, APEH ALDH1A1 574/4885HPGD 703/4885CYP1A2 121/4885
US-20130281727-A1 METAL CARBAMATES FORMED FROM DIAMINOPHENYLMETHANE ARG1, PRMT1, PRMT3 ALDH1A1 1450/4885HPGD 4268/4885CYP1A2 1183/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.