SCHEMBL11037111

SCHEMBL11037111

CCOc1ccc2sc3nc(-c4ccc(OC(C)=O)cc4)cn3c2c1

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 10/20 0.60
▸ TP53 P04637 7/20 0.60
▸ THRB P10828 3/20 0.52
▸ SMN1; SMN2 Q16637 3/20 0.50
▸ POLB P06746 1/20 0.49
▸ KDM4E B2RXH2 1/20 0.48
▸ ALDH1A1 P00352 1/20 0.48
▸ RXFP1 Q9HBX9 2/20 0.48
▸ APP P05067 1/20 0.48
▸ LMNA P02545 3/20 0.46
▸ TSHR P16473 1/20 0.46
▸ RAB9A P51151 1/20 0.46
▸ ATM Q13315 1/20 0.46
▸ TDP1 Q9NUW8 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
SCHEMBL11037107 0.92 MAPT (0.68) MAPTTP53THRBSMN1; SMN2POLB
SCHEMBL11035096 0.88 MAPT (0.60) MAPTTP53THRBSMN1; SMN2POLB
SCHEMBL11011840 0.88 MAPT (0.60) MAPTTP53THRBSMN1; SMN2POLB
SCHEMBL11012567 0.82 TP53 (0.57) MAPTTP53THRBSMN1; SMN2RXFP1
SCHEMBL14875121 0.81 F2RL3 (0.46) MAPTTP53THRBSMN1; SMN2POLB
SCHEMBL11011832 0.79 MAPT (0.69) MAPTTP53THRBSMN1; SMN2POLB
SCHEMBL11035275 0.79 MAPT (0.59) MAPTTP53THRBSMN1; SMN2POLB
SCHEMBL11035093 0.79 MAPT (0.73) MAPTTP53THRBSMN1; SMN2POLB
SCHEMBL11222994 0.78 HSD17B10 (0.48) MAPTTP53THRBSMN1; SMN2KDM4E
SCHEMBL31338680 0.77 MAPT (0.66) MAPTTP53THRBSMN1; SMN2POLB

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-4497817-A ANTIALLERGENS-IMMUNOSUPPRESSIVE AGENTS YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1985-02-05 — — US disclosed
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