SCHEMBL4202113

SCHEMBL4202113

CC(C)N(C(N)=O)c1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.59
LMNA P02545 2/20 0.59
TP53 P04637 1/20 0.59
SMN1; SMN2 Q16637 1/20 0.59
MLYCD O95822 1/20 0.50
TRPM8 Q7Z2W7 2/20 0.49
ALOX5 P09917 1/20 0.48
POLB P06746 1/20 0.43
CYP3A4 P08684 1/20 0.43
PARP1 P09874 1/20 0.43
MAPT P10636 1/20 0.43
TSHR P16473 1/20 0.43
CYP2C19 P33261 1/20 0.43
RECQL P46063 1/20 0.43
BLM P54132 1/20 0.43
PMP22 Q01453 1/20 0.43
HSD17B10 Q99714 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
CHRM2 P08172 1/20 0.42

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
SCHEMBL2640929 0.86 ALOX5 (0.52) ALDH1A1LMNATP53SMN1; SMN2MLYCD
SCHEMBL10576787 0.84 ALDH1A1 (0.47) ALDH1A1LMNATP53SMN1; SMN2MLYCD
SCHEMBL27274107 0.84 ALDH1A1 (0.47) ALDH1A1LMNATP53SMN1; SMN2MLYCD
SCHEMBL2543696 0.83 ALDH1A1 (0.63) ALDH1A1LMNATP53SMN1; SMN2MLYCD
SCHEMBL5079915 0.83 ALDH1A1 (0.63) ALDH1A1LMNATP53SMN1; SMN2MLYCD
SCHEMBL28872772 0.81 ALDH1A1 (0.45) ALDH1A1LMNATP53SMN1; SMN2MLYCD
SCHEMBL4876557 0.81 ALDH1A1 (0.61) ALDH1A1LMNATP53SMN1; SMN2MLYCD
SCHEMBL5932410 0.81 ALDH1A1 (0.61) ALDH1A1LMNATP53SMN1; SMN2MLYCD
SCHEMBL11591363 0.80 ALDH1A1 (0.56) ALDH1A1LMNATP53SMN1; SMN2MLYCD
SCHEMBL1448292 0.80 ALDH1A1 (0.40) ALDH1A1LMNATP53SMN1; SMN2MLYCD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1611109-A4 NOVEL QUINAZOLINE DERIVATIVES AND METHODS OF TREATMENT RELATED TO THE USE THEREOF TAISHO PHARMACEUTICAL CO LTD (JP) 2009-06-24 EP claimed
JP-2006522109-A 2006-09-28 JP claimed
EP-1611109-A1 NOVEL QUINAZOLINE DERIVATIVES AND METHODS OF TREATMENT RELATED TO THE USE THEREOF TAISHO PHARMACEUTICAL CO., LTD (JP) 2006-01-04 EP claimed
WO-2004087680-A1 NOVEL QUINAZOLINE DERIVATIVES AND METHODS OF TREATMENT RELATED TO THE USE THEREOF TAISHO PHARMACEUTICAL CO., LTD. (JP) 2004-10-14 WO claimed
CN-1534029-A Method of synthesizing N-amylidene-N'-cumin urea kind compound 中国科学院大连化学物理研究所 2004-10-06 CN claimed
EP-0182166-B1 PROCESS FOR PREPARING PHENYLISOPROPYLUREA COMPOUNDS AMERICAN CYANAMID COMPANY (US) 1989-05-31 EP claimed
EP-0182166-A2 Process for preparing phenylisopropylurea compounds AMERICAN CYANAMID COMPANY (US) 1986-05-28 EP claimed
US-4578513-A Process for preparing phenylisopropylurea compounds AMERICAN CYANAMID COMPANY (US) 1986-03-25 US claimed
US-4039577-A Process for preparing phenylisopropylurea derivatives SHOWA DENKO K.K. (JA) 1977-08-02 US claimed
WO-2020244968-A1 FUNGICIDAL N-(PYRID-3-YL)CARBOXAMIDES BASF SE (DE) 2020-12-10 WO disclosed
US-9006433-B2 Substituted pyrimidines MERCK SHARP & DOHME CORP. (US) 2015-04-14 US disclosed
CN-1162427-C Amine derivatives compounds ������������ʽ���� 2004-08-18 CN disclosed
US-5864043-A CARDIOVASCULAR DISORDERS AND ANGIOTENSIN ANTAGONIST KARL THOMAE GMBH (DE) 1999-01-26 US disclosed
WO-1998018768-A1 HERBICIDAL 3-(BICYCLIC NITROGEN-CONTAINING HETEROCYCLE)-SUBSTITUTED-1-METHYL-6-TRIFLUOROMETHYLURACILS FMC CORPORATION (US) 1998-05-07 WO disclosed
US-4578513-A Process for preparing phenylisopropylurea compounds AMERICAN CYANAMID COMPANY (US) 1986-03-25 US disclosed
US-4578513-A Process for preparing phenylisopropylurea compounds AMERICAN CYANAMID COMPANY (US) 1986-03-25 US disclosed
US-4578513-A Process for preparing phenylisopropylurea compounds AMERICAN CYANAMID COMPANY (US) 1986-03-25 US disclosed
US-4039577-A Process for preparing phenylisopropylurea derivatives SHOWA DENKO K.K. (JA) 1977-08-02 US disclosed
US-4039577-A Process for preparing phenylisopropylurea derivatives SHOWA DENKO K.K. (JA) 1977-08-02 US disclosed
US-4039577-A Process for preparing phenylisopropylurea derivatives SHOWA DENKO K.K. (JA) 1977-08-02 US disclosed