SCHEMBL16760161

SCHEMBL16760161

COc1ccc(CCP)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TAAR1 Q96RJ0 1/20 0.61
▸ MAOB P27338 2/20 0.55
▸ CALM1 P0DP23 2/20 0.55
▸ IDO1 P14902 2/20 0.54
▸ AOC3 Q16853 2/20 0.53
▸ SIGMAR1 Q99720 1/20 0.53
▸ CA12 O43570 1/20 0.52
▸ CA1 P00915 1/20 0.52
▸ CA2 P00918 1/20 0.52
▸ CA7 P43166 1/20 0.52
▸ CA9 Q16790 1/20 0.52
▸ CA14 Q9ULX7 1/20 0.52
▸ F2RL1 P55085 1/20 0.52
▸ TUBB4A P04350 1/20 0.52
▸ TUBB P07437 1/20 0.52
▸ TUBA3C P0DPH7 1/20 0.52
▸ TUBA1B P68363 1/20 0.52
▸ TUBA4A P68366 1/20 0.52
▸ TUBB4B P68371 1/20 0.52
▸ TUBB3 Q13509 1/20 0.52

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
SCHEMBL834551 0.85 TAAR1 (0.73) TAAR1MAOBCALM1IDO1AOC3
SCHEMBL4187515 0.80 IDO1 (0.58) TAAR1MAOBCALM1IDO1CA12
SCHEMBL244070 0.80 CALM1 (0.79) TAAR1MAOBCALM1IDO1AOC3
SCHEMBL4254058 0.80 CALM1 (0.72) TAAR1MAOBCALM1IDO1AOC3
SCHEMBL10450398 0.78 TAAR1 (0.64) TAAR1MAOBCALM1IDO1AOC3
Hydrochloric Acid SCHEMBL5608519 0.78 IDO1 (0.56) TAAR1MAOBCALM1IDO1CA12
SCHEMBL17400406 0.78 CALM1 (0.69) TAAR1MAOBCALM1IDO1AOC3
Bromide SCHEMBL4224240 0.78 IDO1 (0.56) TAAR1MAOBCALM1IDO1CA12
SCHEMBL10571532 0.78 CALM1 (0.69) TAAR1MAOBCALM1IDO1AOC3
SCHEMBL11007798 0.78 CALM1 (0.69) TAAR1MAOBCALM1IDO1AOC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2997106-A1 METHOD FOR CURING AN ADHESIVE USING MICROWAVE IRRADIATION VTU Holding GmbH (AT) 2016-03-23 — — EP claimed
WO-2015079028-A1 METHOD FOR CURING AN ADHESIVE USING MICROWAVE IRRADIATION VTU HOLDING GMBH (AT) 2015-06-04 — — WO claimed
CN-106029804-B Method for curing adhesives using microwave radiation 普罗奥尼克股份有限公司 2019-09-24 — — CN disclosed
CN-109912586-A The manufacturing method of inner mold -9- azabicyclo [ 3.3.1 ] nonane -3- 01 derivatives 日本曹达株式会社 2019-06-21 — — CN disclosed
CN-106029804-A Method for curing adhesives using microwave radiation 普罗奥尼克股份有限公司 2016-10-12 — — CN disclosed
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