SCHEMBL11322352

SCHEMBL11322352

CSc1cc(O)ccc1NC(C)=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.49
▸ POLB P06746 4/20 0.49
▸ NPC1 O15118 2/20 0.49
▸ RAB9A P51151 2/20 0.49
▸ ALDH1A1 P00352 5/20 0.46
▸ MEN1 O00255 3/20 0.46
▸ KMT2A Q03164 3/20 0.46
▸ CA12 O43570 1/20 0.46
▸ BRD4 O60885 1/20 0.46
▸ NR1I2 O75469 1/20 0.46
▸ CA1 P00915 1/20 0.46
▸ CA2 P00918 1/20 0.46
▸ MB P02144 1/20 0.46
▸ CYP1A1 P04798 1/20 0.46
▸ CA3 P07451 1/20 0.46
▸ CYP3A4 P08684 1/20 0.46
▸ RARG P13631 1/20 0.46
▸ TSHR P16473 1/20 0.46
▸ ALOX5AP P20292 1/20 0.46
▸ CA4 P22748 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
SCHEMBL28349002 0.84 MAPT (0.51) MAPTPOLBNPC1RAB9AALDH1A1
SCHEMBL28634302 0.81 MAPT (0.49) MAPTPOLBNPC1RAB9AALDH1A1
SCHEMBL28349080 0.78 KMT2A (0.58) MAPTNPC1RAB9AALDH1A1MEN1
SCHEMBL28707102 0.78 MIF (0.40) MAPTPOLBNPC1RAB9AALDH1A1
SCHEMBL2896946 0.77 POLB (0.71) MAPTPOLBNPC1RAB9AALDH1A1
SCHEMBL10390825 0.77 POLB (0.41) MAPTPOLBNPC1RAB9AALDH1A1
SCHEMBL4938228 0.77 KMT2A (0.62) MAPTPOLBNPC1RAB9AALDH1A1
SCHEMBL29651063 0.77 KMT2A (0.62) MAPTPOLBNPC1RAB9AALDH1A1
SCHEMBL3624295 0.76 ALDH1A1 (0.44) MAPTPOLBNPC1RAB9AALDH1A1
SCHEMBL28346183 0.76 MAPT (0.55) MAPTALDH1A1MEN1KMT2ACYP1A2

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-4265909-A Inhibiting platelet aggregation with substituted acetanilides SOUTH CAROLINA, MEDICAL UNIVERSITY OF 1981-05-05 — — US disclosed
US-4186209-A Substituted acetanilides as medicinals SOUTH CAROLINA, MEDICAL UNIVERSITY OF 1980-01-29 — — US disclosed
Send feedback