SCHEMBL9127308

SCHEMBL9127308

CCc1cccc(OC(=O)Nc2ccc(Oc3ccc(NC(=O)Oc4cccc(CC)c4)cc3-c3ccc(O)cc3)c(-c3ccc(O)cc3)c2)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 3/20 0.42
▸ FAAH O00519 2/20 0.42
▸ SMN1; SMN2 Q16637 3/20 0.41
▸ POLB P06746 1/20 0.41
▸ ALDH1A1 P00352 3/20 0.40
▸ MAPK1 P28482 2/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ KMT2A Q03164 4/20 0.39
▸ MAPT P10636 4/20 0.39
▸ MEN1 O00255 2/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ KDR P35968 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ CYP1A2 P05177 2/20 0.39
▸ KDM4E B2RXH2 3/20 0.38
▸ GAA P10253 2/20 0.38
▸ USP2 O75604 1/20 0.38
▸ C5AR1 P21730 1/20 0.38
▸ GLA P06280 1/20 0.38

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
SCHEMBL9126479 0.84 MAPT (0.53) FAAHPOLBALDH1A1KMT2AMAPT
SCHEMBL9127249 0.84 KDM4E (0.46) FAAHPOLBALDH1A1KMT2AMAPT
SCHEMBL9125503 0.84 POLB (0.46) RAB9AFAAHPOLBALDH1A1MAPK1
SCHEMBL9124477 0.80 PORCN (0.50) SMN1; SMN2POLBALDH1A1KMT2AMAPT
SCHEMBL9126424 0.79 BRD4 (0.43) RAB9AFAAHPOLBALDH1A1MAPK1
SCHEMBL9122235 0.78 TNIK (0.50) RAB9ASMN1; SMN2POLBALDH1A1MAPK1
SCHEMBL9124116 0.78 GSK3B (0.48) SMN1; SMN2POLBALDH1A1MAPTLMNA
SCHEMBL9126984 0.78 MGLL (0.57) RAB9ASMN1; SMN2POLBALDH1A1MAPT
SCHEMBL9129140 0.78 GAA (0.49) FAAHALDH1A1MAPK1CYP3A4KMT2A
SCHEMBL9128905 0.77 C5AR1 (0.50) RAB9ASMN1; SMN2ALDH1A1KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0524419-B1 Heat-sensitive recording materials and phenol compounds MITSUI TOATSU CHEMICALS (JP) 1995-09-06 — — EP disclosed
US-5391806-A A storage stable chromogens as color-developing agent or stabilizers MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1995-02-21 — — US disclosed
US-5270281-A Chromogenic compound MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1993-12-14 — — US disclosed
EP-0524419-A1 Heat-sensitive recording materials and phenol compounds MITSUI TOATSU CHEMICALS, Inc. (JP) 1993-01-27 — — EP disclosed
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