SCHEMBL6546128

SCHEMBL6546128

CCCc1ccc(Cc2ccccc2)cc1

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CALM1 P0DP23 1/20 0.60
LTA4H P09960 2/20 0.52
ATM Q13315 1/20 0.50
TAAR1 Q96RJ0 1/20 0.50
SIGMAR1 Q99720 2/20 0.49
LMNA P02545 1/20 0.48
TP53 P04637 1/20 0.48
SLC22A2 O15244 1/20 0.47
LPL P06858 1/20 0.46
LIPG Q9Y5X9 1/20 0.46
MAOA P21397 1/20 0.46
MAOB P27338 1/20 0.46
ALDH1A1 P00352 1/20 0.46
HPGD P15428 1/20 0.46
ALOX15 P16050 1/20 0.46
ALOX12 P18054 1/20 0.46
CASP1 P29466 1/20 0.46
HSD17B10 Q99714 1/20 0.46
PLK1 P53350 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45

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
SCHEMBL6546791 0.90 MAOA (0.56) ATMTAAR1SIGMAR1TP53LPL
SCHEMBL2494578 0.89 LPL (0.54) TAAR1LPLLIPGALDH1A1PLK1
SCHEMBL11594885 0.89 TP53 (0.58) ATMTAAR1SIGMAR1TP53ALDH1A1
SCHEMBL40575 0.89
Benzene SCHEMBL3223041 0.89 TP53 (0.58) ATMTAAR1SIGMAR1TP53ALDH1A1
Benzene SCHEMBL28308118 0.89 TP53 (0.58) ATMTAAR1SIGMAR1TP53ALDH1A1
Dimethylamine SCHEMBL23922801 0.87 TAAR1 (0.58) CALM1ATMTAAR1SIGMAR1LMNA
Bromide SCHEMBL7216374 0.87 TP53 (0.55) ATMTAAR1SIGMAR1TP53ALDH1A1
Ammonia Solution, Strong SCHEMBL479482 0.87 TP53 (0.55) ATMTAAR1SIGMAR1TP53ALDH1A1
Hydrochloric Acid SCHEMBL5792976 0.87 TP53 (0.55) ATMTAAR1SIGMAR1TP53MAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240407250-A1 COMPOSITION FOR ORGANIC ELECTROLUMINESCENT ELEMENT, METHOD FOR PRODUCING ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, DISPLAY DEVICE, AND ILLUMINATOR MITSUBISHI CHEMICAL CORPORATION (JP) 2024-12-05 US disclosed
WO-2023153161-A1 COMPOSITION FOR ORGANIC ELECTROLUMINESCENT ELEMENT, METHOD FOR MANUFACTURING ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, DISPLAY DEVICE, AND LIGHTING DEVICEELECTROLUMINESCENCE ELEMENT, DISPLAY DEVICE, AND LIGHTING DEVICE 三菱ケミカル株式会社 2023-08-17 WO disclosed
WO-2012069856-A1 ANTIMALARIAL COMPOUNDS LIVERPOOL SCHOOL OF TROPICAL MEDICINE (GB) 2012-05-31 WO disclosed
EP-0717098-B1 A refrigerating machine oil and a fluid composition for use in a refrigerating machine NIPPON MITSUBISHI OIL CORP (JP) 2004-01-21 EP disclosed
US-5817251-A AROMATIC HYDROCARBON LUBRICANT NIPPON OIL CO., LTD. (JP) 1998-10-06 US disclosed
US-5711895-A Fluid composition for use in a refrigerating machine in which the refrigerating machine oil is at least one hydrocarbon compound of a formula consisting of two phenyl groups joined through an alkylene or alkenylene group NIPPON OIL CO., LTD. (JP) 1998-01-27 US disclosed
EP-0717098-A2 A refrigerating machine oil and a fluid composition for use in a refrigerating machine NIPPON OIL CO. LTD. (JP) 1996-06-19 EP disclosed