SCHEMBL9005282

SCHEMBL9005282

CC=CCCc1ccc(OC)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.53
TP53 P04637 2/20 0.50
CYP3A4 P08684 2/20 0.50
TSHR P16473 2/20 0.50
ALDH1A1 P00352 2/20 0.50
F2RL1 P55085 1/20 0.50
LMNA P02545 1/20 0.50
GPR52 Q9Y2T5 1/20 0.50
KDM4E B2RXH2 1/20 0.50
MAOB P27338 2/20 0.48
CALM1 P0DP23 1/20 0.48
IDO1 P14902 3/20 0.48
AGXT P21549 2/20 0.48
SIGMAR1 Q99720 1/20 0.47
AOC3 Q16853 1/20 0.47
ALOX15 P16050 1/20 0.47
ALOX12 P18054 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
TUBB4A P04350 1/20 0.46
TUBB P07437 1/20 0.46

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
SCHEMBL9005279 1.00 TAAR1 (0.53) TAAR1TP53CYP3A4TSHRALDH1A1
SCHEMBL12991282 0.94 MAOB (0.58) TAAR1TP53CYP3A4TSHRALDH1A1
SCHEMBL18902086 0.94 MAOB (0.58) TAAR1TP53CYP3A4TSHRALDH1A1
SCHEMBL8029382 0.90 APP (0.47) TAAR1TP53CYP3A4TSHRALDH1A1
SCHEMBL8029380 0.90 APP (0.47) TAAR1TP53CYP3A4TSHRALDH1A1
SCHEMBL7789022 0.87 GRIN2D (0.50) TAAR1TP53CYP3A4TSHRALDH1A1
SCHEMBL7789030 0.87 GRIN2D (0.50) TAAR1TP53CYP3A4TSHRALDH1A1
SCHEMBL7789026 0.87 GRIN2D (0.50) TAAR1TP53CYP3A4TSHRALDH1A1
SCHEMBL13224765 0.86 MAOB (0.45) TAAR1TP53CYP3A4TSHRALDH1A1
SCHEMBL3085735 0.83 TAAR1 (0.57) TAAR1TP53CYP3A4TSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5550284-A Production method for alkoxynaphthalenecarboxylic acid SUMIKIN CHEMICAL CO., LTD. (JP) 1996-08-27 US disclosed