SCHEMBL805503

SCHEMBL805503

CCc1ccnc2ccccc12

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 1/20 0.64
NCF1 P14598 1/20 0.52
CYP1A2 P05177 1/20 0.51
HTR1A P08908 2/20 0.50
ADRA1D P25100 2/20 0.50
ADRA1A P35348 2/20 0.50
ADRA1B P35368 2/20 0.50
CYP3A4 P08684 1/20 0.47
CYP2D6 P10635 1/20 0.47
HIF1A Q16665 1/20 0.47
KDM4E B2RXH2 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
ALDH1A1 P00352 1/20 0.46
LMNA P02545 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
MAPT P10636 2/20 0.44
NPC1 O15118 1/20 0.44
TP53 P04637 1/20 0.44

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
Bromide SCHEMBL10672971 0.96 LOXL2 (0.60) LOXL2NCF1CYP1A2HTR1AADRA1D
SCHEMBL763204 0.85 MAPT (0.54) LOXL2CYP3A4HIF1AKDM4ESMN1; SMN2
SCHEMBL528996 0.83 LOXL2 (0.60) LOXL2NCF1CYP1A2HTR1AADRA1D
SCHEMBL3972788 0.83 LOXL2 (0.64) LOXL2NCF1CYP1A2HTR1AADRA1D
Bromide SCHEMBL7457488 0.82 LOXL2 (0.58) LOXL2NCF1CYP1A2HTR1AADRA1D
Iodide SCHEMBL1343657 0.82 LOXL2 (0.58) LOXL2NCF1CYP1A2HTR1AADRA1D
SCHEMBL12854172 0.81 LOXL2 (0.53) LOXL2NCF1CYP1A2HTR1AADRA1D
SCHEMBL2237676 0.80 LOXL2 (0.56) LOXL2NCF1CYP1A2HTR1AADRA1D
SCHEMBL30665033 0.80 LOXL2 (0.56) LOXL2NCF1CYP1A2HTR1AADRA1D
SCHEMBL334360 0.80 LOXL2 (0.67) LOXL2NCF1CYP1A2HTR1AADRA1D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117986186-A Quinoline chemical tracer for multistage fracturing, tracing method, fracturing fluid and application 中国石油化工股份有限公司 2024-05-07 CN claimed
CN-109776406-B Method for cross coupling of ether compound and quinoline derivative 湘潭大学 2021-05-04 CN claimed
US-9796800-B2 Process for producing polydienes BRIDGESTONE CORPORATION (JP) 2017-10-24 US claimed
US-20160108153-A1 PROCESS FOR PRODUCING POLYDIENES BRIDGESTONE CORPORATION (JP) 2016-04-21 US claimed
CN-103154044-B Process for producing polydienes BRIDGESTONE CO.,LTD. (JP) 2016-02-17 CN claimed
US-9249244-B2 Process for producing polydienes BRIDGESTONE CORPORATION (JP) 2016-02-02 US claimed
EP-2619233-A1 PROCESS FOR PRODUCING POLYDIENES Bridgestone Corporation (JP) 2013-07-31 EP claimed
CN-103154044-A Process for producing polydienes BRIDGESTONE CORP 2013-06-12 CN claimed
WO-2012040026-A1 PROCESS FOR PRODUCING POLYDIENES BRIDGESTONE CORPORATION (JP) 2012-03-29 WO claimed
EP-1100797-B1 HETEROCYCLIC COMPOUNDS AS INHIBITORS OF ROTAMASE ENZYMES PFIZER LTD (GB) 2003-02-26 EP claimed
US-6372736-B1 ENZYME INHIBITORS PFIZER INC 2002-04-16 US claimed
EP-1100797-A1 HETEROCYCLIC COMPOUNDS AS INHIBITORS OF ROTAMASE ENZYMES Pfizer Limited (GB) 2001-05-23 EP claimed
WO-2000005232-A1 HETEROCYCLIC COMPOUNDS AS INHIBITORS OF ROTAMASE ENZYMES PFIZER LIMITED (GB) 2000-02-03 WO claimed
EP-3630770-B1 PYRAZOLO[3,4-B]PYRAZINE DERIVATIVES AS SHP2 PHOSPHATASE INHIBITORS RELAY THERAPEUTICS INC (US) 2024-08-28 EP disclosed
CN-118084724-A Method for preparing aryl nitrile by copper-catalyzed oxidation and cleavage of alkyl-substituted aromatic ring and aromatic heterocyclic carbon-carbon bond 中国科学院大连化学物理研究所 2024-05-28 CN disclosed
CN-117986186-A Quinoline chemical tracer for multistage fracturing, tracing method, fracturing fluid and application 中国石油化工股份有限公司 2024-05-07 CN disclosed
US-5093333-A N-substituted-2-aminoquinolines useful for treating hypofunction of the cholinergic system AMERICAN HOME PRODUCTS CORPORATION (US) 1992-03-03 US disclosed
EP-0363212-A2 Novel heterocyclic compounds and anticancer-drug reinforcing agents containing them as effective components MITSUI TOATSU CHEMICALS, Inc. (JP) 1990-04-11 EP disclosed
US-4791106-A 1-Carbacephalosporin antibiotics ELI LILLY AND COMPANY (US) 1988-12-13 US disclosed
US-4065510-A LITHIUM PHOSPHATE CATALYST DEUTSCHE GOLD- UND SILBER-SCHEIDEANSTALT VORMALS ROESSLER (DT) 1977-12-27 US disclosed