SCHEMBL9735313

SCHEMBL9735313

COCC1(C)Oc2ccc(C(=O)OC)cc2C(Oc2ccc(=O)[nH]n2)C1(C)O

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.32
IDO1 P14902 1/20 0.32
SMN1; SMN2 Q16637 2/20 0.31
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
KMT2A Q03164 1/20 0.31
RARB P10826 1/20 0.30
RARG P13631 1/20 0.30
MAPT P10636 1/20 0.30
RAB9A P51151 1/20 0.30

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
SCHEMBL9735545 0.86
SCHEMBL9737765 0.84 ABCB1 (0.38) MEN1KMT2A
SCHEMBL9736949 0.84 MAPT (0.32) SMN1; SMN2MEN1ALDH1A1KMT2AMAPT
SCHEMBL9736521 0.83 AXL (0.32) ALOX5IDO1SMN1; SMN2MEN1ALDH1A1
SCHEMBL9736085 0.82 IDO1 (0.34) ALOX5IDO1SMN1; SMN2MEN1ALDH1A1
SCHEMBL9735767 0.81 ALOX5 (0.33) ALOX5SMN1; SMN2RARBRARGMAPT
SCHEMBL9735212 0.79 CA12 (0.34) ALOX5IDO1SMN1; SMN2MEN1KMT2A
SCHEMBL9735222 0.75 RARB (0.33) ALOX5IDO1SMN1; SMN2MEN1ALDH1A1
SCHEMBL7331735 0.72 ABCB1 (0.39)
SCHEMBL7334077 0.71 ALOX5 (0.34) ALOX5SMN1; SMN2MEN1ALDH1A1KMT2A

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-5130322-A CHROMAN DERIVATIVES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1992-07-14 US disclosed
EP-0415065-A1 Chroman derivatives MERCK PATENT GmbH (DE) 1991-03-06 EP disclosed