SCHEMBL11197020

SCHEMBL11197020

Cc1ccccc1Cc1ccccc1-c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 1/20 0.52
▸ PDCD1 Q15116 1/20 0.50
▸ CD274 Q9NZQ7 1/20 0.50
▸ HTR7 P34969 3/20 0.47
▸ SCN8A Q9UQD0 1/20 0.45
▸ KMT2A Q03164 1/20 0.44
▸ ALDH1A1 P00352 3/20 0.43
▸ LMNA P02545 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ TAAR1 Q96RJ0 1/20 0.42
▸ CA12 O43570 1/20 0.41
▸ CA1 P00915 1/20 0.41
▸ CA2 P00918 1/20 0.41
▸ CA7 P43166 1/20 0.41
▸ CA9 Q16790 1/20 0.41
▸ CA14 Q9ULX7 1/20 0.41
▸ CYP2A6 P11509 1/20 0.41
▸ CYP2B6 P20813 1/20 0.41
▸ P2RX7 Q99572 1/20 0.39

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
SCHEMBL31387875 0.87 DPP4 (0.65) DPP4PDCD1CD274HTR7KMT2A
SCHEMBL2841431 0.87 DPP4 (0.65) DPP4PDCD1CD274HTR7KMT2A
SCHEMBL25138000 0.83 CD274 (0.47) DPP4PDCD1CD274HTR7SCN8A
SCHEMBL9517857 0.83 PPARG (0.46) DPP4PDCD1CD274HTR7SCN8A
SCHEMBL11207028 0.83 TAAR1 (0.52) DPP4PDCD1CD274HTR7SCN8A
SCHEMBL11201350 0.83 TAAR1 (0.45) HTR7KMT2AALDH1A1TAAR1CA12
SCHEMBL29477327 0.82 TAAR1 (0.56) KMT2AALDH1A1LMNATAAR1P2RX7
SCHEMBL2090458 0.82 TAAR1 (0.56) KMT2AALDH1A1LMNATAAR1P2RX7
SCHEMBL10759630 0.81 CD274 (0.49) DPP4PDCD1CD274HTR7SCN8A
SCHEMBL340250 0.80 DPP4 (0.58) DPP4PDCD1CD274HTR7KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106946648-B Fluorene compound and method for producing fluorene compound 爱思开新材料捷恩智株式会社 2021-06-04 — — CN disclosed
CN-106946648-A The manufacture method of compound of fluorene class and compound of fluorene class JNC株式会社 2017-07-14 — — CN disclosed
US-4371726-A Composition suitable for mechanical power transmission and process for operating traction drives NIPPON STEEL CHEMICAL CO., LTD. (JP) 1983-02-01 — — US disclosed
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