SCHEMBL333550

SCHEMBL333550

Nc1ccc(CNc2ccccc2)cc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.58
CYP3A4 P08684 2/20 0.58
CYP2C9 P11712 2/20 0.58
CYP2C19 P33261 2/20 0.58
MEN1 O00255 1/20 0.58
KMT2A Q03164 1/20 0.58
FFAR1 O14842 2/20 0.55
PTPRF P10586 1/20 0.55
PTPN2 P17706 1/20 0.55
PTPN1 P18031 1/20 0.55
PTPN11 Q06124 1/20 0.55
HTT P42858 2/20 0.53
MAOB P27338 4/20 0.52
MAOA P21397 3/20 0.52
ALDH1A1 P00352 1/20 0.52
MAPT P10636 1/20 0.52
ALOX12 P18054 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
HDAC3 O15379 1/20 0.51
HDAC1 Q13547 1/20 0.51

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
SCHEMBL564987 0.91 HTT (0.64) CYP1A2CYP3A4CYP2C9CYP2C19MEN1
SCHEMBL22669878 0.89 HTT (0.57) CYP1A2CYP3A4CYP2C9CYP2C19MEN1
SCHEMBL455536 0.89 MEN1 (0.50) CYP1A2CYP3A4CYP2C9CYP2C19MEN1
SCHEMBL3422016 0.89 MEN1 (0.50) CYP1A2CYP3A4CYP2C9CYP2C19MEN1
SCHEMBL5154356 0.89 MEN1 (0.50) CYP1A2CYP3A4CYP2C9CYP2C19MEN1
SCHEMBL2065031 0.89 CYP1A2 (0.69) CYP1A2CYP3A4CYP2C9CYP2C19MEN1
SCHEMBL31396238 0.88 HTT (0.56) CYP1A2CYP3A4CYP2C9CYP2C19MEN1
SCHEMBL11936095 0.88 FFAR1 (0.63) CYP1A2CYP3A4CYP2C9CYP2C19MEN1
Hydrochloric Acid SCHEMBL2985269 0.86 MAOA (0.48) CYP1A2CYP3A4CYP2C9CYP2C19MEN1
Hydrochloric Acid SCHEMBL4949253 0.86 MAOA (0.48) CYP1A2CYP3A4CYP2C9CYP2C19MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2268713-B1 PROCESS FOR MAKING POLYAMINOPOLYPHENYL METHANES USING A MIXED SOLID ACID CATALYST SYSTEM DOW GLOBAL TECHNOLOGIES LLC (US) 2018-02-21 EP claimed
EP-1616890-B1 Method for producing of polyamines of the diphenylmethane series with low degree of protonation COVESTRO DEUTSCHLAND AG (DE) 2016-11-30 EP claimed
EP-2019092-B1 PROCESS FOR PRODUCING POLYAMINE MITSUI CHEMICALS INC (JP) 2013-07-03 EP claimed
EP-2019092-A1 PROCESS FOR PRODUCING POLYAMINE Mitsui Chemicals Polyurethanes, Inc. (JP) 2009-01-28 EP claimed
US-7253321-B2 Process for the preparation of polyamines of the diphenylmethane series at a low degree of protonation BAYER MATERIALSCIENCE AG (DE) 2007-08-07 US claimed
US-20060287555-A1 Process for the preparation of polyamines of the diphenylmethane series at a low degree of protonation COVESTRO DEUTSCHLAND AG (DE) 2006-12-21 US claimed
EP-1616890-A1 Method for producing of polyamines of the diphenylmethane series with low degree of protonation Bayer MaterialScience AG (DE) 2006-01-18 EP claimed
US-5241119-A Condensation of aniline with aldehyde; isomerization of chemical intermediate; using zeolite catalys ENIRICERCHE S.P.A. (IT) 1993-08-31 US claimed
EP-0264744-B1 PROCESS FOR THE PREPARATION OF 4,4'-DIAMINODIPHENYLMETHANE AND ITS DERIVATIVES ENIRICERCHE S.p.A. (IT) 1992-12-23 EP claimed
EP-0264744-A2 Process for the preparation of 4,4'-diaminodiphenylmethane and its derivatives ENIRICERCHE S.p.A. (IT) 1988-04-27 EP claimed
EP-4345088-B1 A PROCESS FOR PREPARING DI- AND POLYAMINES OF THE DIPHENYL METHANE SERIES COVESTRO DEUTSCHLAND AG (DE) 2025-10-22 EP disclosed
CN-119684159-A Method for reducing content of hydrolytic chlorine in isocyanate 万华化学(福建)异氰酸酯有限公司 2025-03-25 CN disclosed
EP-4345088-A1 A PROCESS FOR PREPARING DI- AND POLYAMINES OF THE DIPHENYL METHANE SERIES Covestro Deutschland AG (DE) 2024-04-03 EP disclosed
CN-117430767-A Process for the preparation of diamines and polyamines of the diphenylmethane series 科思创德国股份有限公司 2024-01-23 CN disclosed
WO-2023186874-A1 DISPERSE AZO DYES BASED ON 2-HYDROXYNAPHTHALENE-3-CARBOXYLIC ACID HUNTSMAN ADVANCED MATERIALS (SWITZERLAND) GMBH (CH) 2023-10-05 WO disclosed
US-4147724-A Process for the preparation of polyamines BAYER AKTIENGESELLSCHAFT (DE) 1979-04-03 US disclosed
US-4146727-A ACID CATALYSTS ATLANTIC RICHFIELD COMPANY (US) 1979-03-27 US disclosed
US-4110070-A QUATERNIZING INDOLENINE METHINE COMPOUND ON FIBERS TO FORM CATIONIC DYE HODOGAYA CHEMICAL CO., LTD. (JP) 1978-08-29 US disclosed
US-4093658-A CONDENSING AN AROMATIC AMINE WITH FORMALDEHYDE BAYER AKTIENGESELLSCHAFT (DT) 1978-06-06 US disclosed
US-4087459-A Process for the preparation of polyamines BAYER AKTIENGESELLSCHAFT (DT) 1978-05-02 US 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 (1 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-20060287555-A1 Process for the preparation of polyamines of the diphenylmethane series at a low degree of protonation SRM, PNMT, DNMT1 CYP1A2 1969/4885CYP3A4 1894/4885CYP2C9 3396/4885

“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.