SCHEMBL9660764

SCHEMBL9660764

O=C(Cc1c[nH]c2ccccc12)Oc1ccc(C(=O)O)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 4/20 0.64
MEN1 O00255 4/20 0.60
MAPT P10636 4/20 0.60
KMT2A Q03164 4/20 0.60
ALDH1A1 P00352 2/20 0.60
SMN1; SMN2 Q16637 2/20 0.60
LMNA P02545 1/20 0.60
CYP1A2 P05177 1/20 0.60
CYP3A4 P08684 1/20 0.60
CYP2C19 P33261 1/20 0.60
PKM P14618 1/20 0.58
KDM4E B2RXH2 1/20 0.56
HPGD P15428 1/20 0.56
SLC6A2 P23975 1/20 0.53
FNTA P49354 1/20 0.53
FNTB P49356 1/20 0.53
FAAH O00519 2/20 0.52
GPR84 Q9NQS5 2/20 0.48
NPC1 O15118 1/20 0.48
POLB P06746 1/20 0.48

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
SCHEMBL2003499 0.90 MAPT (0.68) HRH3MEN1MAPTKMT2AALDH1A1
SCHEMBL9418839 0.85 HRH3 (0.67) HRH3MEN1MAPTKMT2AALDH1A1
SCHEMBL11136033 0.84 PKM (0.69) HRH3MEN1MAPTKMT2AALDH1A1
SCHEMBL22076466 0.81 KMT2A (0.56) HRH3MEN1MAPTKMT2AALDH1A1
SCHEMBL27996401 0.80 HRH3 (0.58) HRH3MEN1MAPTKMT2AALDH1A1
SCHEMBL4451971 0.80 HRH3 (0.57) HRH3MEN1MAPTKMT2AALDH1A1
SCHEMBL21819729 0.79 HRH3 (0.58) HRH3MEN1MAPTKMT2AALDH1A1
SCHEMBL13280575 0.79 MAPT (0.60) HRH3MEN1MAPTKMT2AALDH1A1
SCHEMBL6072594 0.78 HRH3 (0.58) HRH3MEN1MAPTKMT2AALDH1A1
SCHEMBL4454584 0.78 HRH3 (0.58) HRH3MEN1MAPTKMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5143536-A Water Swellable Gel Containing Auxin RUNKIS WALTER H (US) 1992-09-01 US claimed
US-5143536-A Water Swellable Gel Containing Auxin RUNKIS WALTER H (US) 1992-09-01 US disclosed