SCHEMBL8095627

SCHEMBL8095627

Cc1ccccc1Cc1ccc(Cc2ccccc2C)cc1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ LTA4H P09960 1/20 0.53
▸ TAAR1 Q96RJ0 1/20 0.52
▸ KEAP1 Q14145 1/20 0.48
▸ TSHR P16473 1/20 0.47
▸ ACHE P22303 1/20 0.47
▸ SLC6A2 P23975 1/20 0.44
▸ SLC6A4 P31645 1/20 0.44
▸ SLC6A3 Q01959 1/20 0.44
▸ CHRM2 P08172 1/20 0.43
▸ PTGS1 P23219 1/20 0.43
▸ PTGS2 P35354 1/20 0.43
▸ AR P10275 1/20 0.43
▸ POLB P06746 1/20 0.43
▸ HTR2A P28223 1/20 0.43
▸ FFAR1 O14842 1/20 0.43
▸ CALM1 P0DP23 1/20 0.43

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
SCHEMBL6378299 0.93 POLB (0.51) LTA4HTAAR1KEAP1TSHRACHE
SCHEMBL2140995 0.93 CALM1 (0.57) LTA4HTAAR1KEAP1TSHRHTR2A
SCHEMBL29940610 0.92 CALM1 (0.55) LTA4HTAAR1TSHRACHEHTR2A
SCHEMBL9741301 0.92 CALM1 (0.55) LTA4HTAAR1TSHRACHEHTR2A
SCHEMBL275838 0.92 CALM1 (0.55) LTA4HTAAR1TSHRACHEHTR2A
SCHEMBL27614158 0.90 CALM1 (0.52) LTA4HTAAR1TSHRACHEHTR2A
Hydrochloric Acid SCHEMBL21175607 0.90 CALM1 (0.52) LTA4HTAAR1TSHRHTR2ACALM1
SCHEMBL10863097 0.90 CALM1 (0.52) LTA4HTAAR1TSHRHTR2ACALM1
SCHEMBL1584083 0.89 LTA4H (0.46) LTA4HTAAR1KEAP1TSHRACHE
SCHEMBL3926343 0.89 KEAP1 (0.67) LTA4HTAAR1KEAP1

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
EP-0708077-B1 Diamino compounds and methods for preparing them CHISSO CORP (JP) 2000-12-27 — — EP disclosed
US-5663440-A Diamino compounds and methods for preparing them CHISSO CORPORATION (JP) 1997-09-02 — — US disclosed
EP-0708077-A1 Diamino compounds and methods for preparing them CHISSO CORPORATION (JP) 1996-04-24 — — EP disclosed
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