SCHEMBL899

SCHEMBL899

N#Cc1ccccc1CBr

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.46
SMN1; SMN2 Q16637 4/20 0.44
TSHR P16473 4/20 0.44
ALDH1A1 P00352 2/20 0.44
MAPT P10636 1/20 0.44
CYP1A1 P04798 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP1B1 Q16678 1/20 0.43
SLC6A2 P23975 2/20 0.39
SLC6A4 P31645 2/20 0.39
KDM4E B2RXH2 1/20 0.38
HPGD P15428 1/20 0.38
HSD17B10 Q99714 1/20 0.38
FFAR1 O14842 1/20 0.37
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36

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
SCHEMBL29513232 1.00 CYP19A1 (0.46) CYP19A1SMN1; SMN2TSHRALDH1A1MAPT
SCHEMBL8932055 0.98 CYP19A1 (0.44) CYP19A1SMN1; SMN2TSHRALDH1A1MAPT
SCHEMBL1841101 0.98 SMN1; SMN2 (0.47) CYP19A1SMN1; SMN2TSHRALDH1A1MAPT
SCHEMBL16830262 0.90 CYP19A1 (0.40) CYP19A1SMN1; SMN2TSHRALDH1A1MAPT
SCHEMBL588692 0.83 ESR2 (0.44) CYP19A1SMN1; SMN2TSHRALDH1A1MAPT
SCHEMBL5728797 0.82 CYP19A1 (0.43) CYP19A1SMN1; SMN2TSHRALDH1A1MAPT
SCHEMBL13863637 0.82 CYP1A1 (0.45) CYP19A1SMN1; SMN2TSHRALDH1A1MAPT
SCHEMBL30252315 0.82 CYP19A1 (0.43) CYP19A1SMN1; SMN2TSHRALDH1A1MAPT
SCHEMBL20631601 0.81 ALDH1A1 (0.42) CYP19A1SMN1; SMN2TSHRALDH1A1MAPT
SCHEMBL28716705 0.81 GLA (0.43) CYP19A1SMN1; SMN2ALDH1A1SLC6A2SLC6A4

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

Appears in 2783 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117736448-A Coordination polymer based on iron hydrogenase and preparation method and application thereof 南京晓庄学院 2024-03-22 CN claimed
CN-117700368-A Synthesis method of pentanitrogen guanidine salt chiral phase transfer catalyst 四川大学 2024-03-15 CN claimed
CN-117285477-A Synthesis process and device of letrozole 河南康达制药有限公司 2023-12-26 CN claimed
CN-117024416-A Hemicyanine compound and pharmaceutical composition, preparation method and application thereof 中国药科大学 2023-11-10 CN claimed
CN-116855100-A Triphenylamine dye capable of being directly used for latent fingerprint development and preparation method and application thereof 青岛科技大学 2023-10-10 CN claimed
CN-115521228-B BChE and HDAC double-target inhibitor and preparation method and application thereof 中国药科大学 2023-08-22 CN claimed
CN-114149421-B Palmatine derivatives, preparation method and antithrombotic use thereof 中国医学科学院医药生物技术研究所 2023-04-25 CN claimed
CN-115536597-A Preparation method of high-purity alogliptin benzoate intermediate 山东新华制药股份有限公司 2022-12-30 CN claimed
CN-114354802-A Method for analyzing contents of two cyano bromobenzyl isomers in alogliptin benzoate 山东大学 2022-04-15 CN claimed
CN-114149421-A Palmatine derivative, preparation method and antithrombotic application thereof 中国医学科学院医药生物技术研究所 2022-03-08 CN claimed
CN-102718673-A Novel technology for synthesis of aminomethylbenzoic acid JIANG CHANG 2012-10-10 CN claimed
CN-102321102-A N2,N4-disubstituted-2H,4H-pyrrole[1,2-b][1,2,4,6] thiatriazine-1,1,3-triketone derivatives as well as preparation and application thereof UNIV SHANDONG 2012-01-18 CN claimed
CN-102174318-A Synthesis and application of activity-based permeable membrane fluorescent small molecular probe for in-vivo marking of protein tyrosine phosphatase UNIV HUAZHONG SCIENCE TECH 2011-09-07 CN claimed
CN-101407455-A Preparation method of 4, 4' -stilbene dicarboxylic acid DALIAN RES AND DESIGN INST OF (CN) 2009-04-15 CN claimed
CN-1688298-A Composition, Synthesis and Therapeutic Use of Polyamines MURPHY MICHAEL A (US) 2005-10-26 CN claimed
CN-1173938-C Alpha-substitution of unprotected beta-amino ester compounds ���µ�˹ҩ�﹫˾ 2004-11-03 CN claimed
CN-1334799-A Alpha-substitution of unprotected beta-amino ester compounds AVENTIS PHARM PROD INC (US) 2002-02-06 CN claimed
US-6140508-A USEFUL IN THE PREPARATION OF FARNESYL-PROTEIN TRANSFERASE INHIBITORS. MERCK & CO., INC. (US) 2000-10-31 US claimed
WO-2000001674-A1 PROCESS FOR MAKING 1,5-DISUBSTITUTED IMIDAZOLES MERCK & CO., INC. (US) 2000-01-13 WO claimed
US-5565602-A REACTING A HYDROCARBYL CHLORIDE WITH A CARBONYL SULFIDE AND AMINE IN PRESENCE OF A BASIC CATALYST PHILLIPS PETROLEUM COMPANY (US) 1996-10-15 US claimed