SCHEMBL6550332

SCHEMBL6550332

Cc1cc(Cl)cc(C)[n+]1[O-]

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.52
KDM4E B2RXH2 2/20 0.39
ALDH1A1 P00352 5/20 0.36
CYP1A2 P05177 1/20 0.33
NPC1 O15118 1/20 0.31
S1PR4 O95977 1/20 0.31
MAPT P10636 1/20 0.31
S1PR1 P21453 1/20 0.31
HTT P42858 1/20 0.31
RAB9A P51151 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
MAT2A P31153 1/20 0.30
TP53 P04637 1/20 0.30
CYP3A4 P08684 1/20 0.30

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
Hydrochloric Acid SCHEMBL11613262 0.97 TSHR (0.50) TSHRKDM4EALDH1A1CYP1A2
SCHEMBL2534916 0.87 TSHR (0.41) TSHRKDM4EALDH1A1CYP1A2
Hydrochloric Acid SCHEMBL11612086 0.81 TSHR (0.37) TSHRALDH1A1CYP1A2TP53CYP3A4
Hydrochloric Acid SCHEMBL11611435 0.78 TSHR (0.34) TSHRALDH1A1CYP1A2
Hydrochloric Acid SCHEMBL11615631 0.78 TSHR (0.48) TSHRALDH1A1CYP1A2
SCHEMBL667047 0.75 TSHR (0.57) TSHRKDM4EALDH1A1NPC1S1PR4
SCHEMBL11616216 0.75 TSHR (0.36) TSHR
Hydrochloric Acid SCHEMBL11615853 0.73 TSHR (0.35) TSHRALDH1A1
Hydrochloric Acid SCHEMBL11611137 0.73 TSHR (0.31) TSHRALDH1A1
Hydrochloric Acid SCHEMBL11611360 0.73 TRPM8 (0.32) TSHRALDH1A1

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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119968360-A Quinazoline compound and application thereof 赛诺哈勃药业(成都)有限公司 2025-05-09 CN disclosed
WO-2024131938-A1 QUINAZOLINE COMPOUND AND USE THEREOF 赛诺哈勃药业(成都)有限公司 2024-06-27 WO disclosed
CN-1511140-A Oxime ether compound and agricultural or horticultural bactericide �ձ�������ʽ���� 2004-07-07 CN disclosed
US-20040116480-A1 Oxime ether compound and agricultural or horticultural bactericide NIPPON SODA CO., LTD. (JP) 2004-06-17 US disclosed
EP-1236717-B1 OXIME O-ETHER COMPOUNDS AND FUNGICIDES FOR AGRICULTURAL AND HORTICULTURAL USE NIPPON SODA CO (JP) 2004-02-04 EP disclosed
EP-1362850-A1 OXIME ETHER COMPOUND AND AGRICULTURAL OR HORTICULTURAL BACTERICIDE NIPPON SODA CO., LTD. (JP) 2003-11-19 EP disclosed
US-6589967-B1 Fungicide for agricultural and horticultural use comprising the compound as the active ingredient. agricultural plant protection chemicals have been used for controlling plant diseases. NIPPON SODA CO. LTD. (JP) 2003-07-08 US disclosed
EP-1236717-A1 OXIME O-ETHER COMPOUNDS AND FUNGICIDES FOR AGRICULTURAL AND HORTICULTURAL USE NIPPON SODA CO., LTD. (JP) 2002-09-04 EP disclosed
US-6162809-A Pyridylthio compounds for controlling helicobacter bacteria BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 2000-12-19 US disclosed
US-4122264-A Pyridine containing morpholines THE UPJOHN COMPANY (US) 1978-10-24 US disclosed
US-4115396-A HYPOTENSIVE AGENTS THE UPJOHN COMPANY (US) 1978-09-19 US disclosed
US-4067874-A Novel pyridine 1-oxides THE UPJOHN COMPANY (US) 1978-01-10 US disclosed