SCHEMBL10466283

SCHEMBL10466283

COC(=O)c1ccc(COc2ccc(C=C(C#N)C#N)cc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 6/20 0.64
▸ RAB9A P51151 6/20 0.64
▸ MAPT P10636 6/20 0.59
▸ KMT2A Q03164 6/20 0.59
▸ MEN1 O00255 5/20 0.59
▸ SMN1; SMN2 Q16637 3/20 0.59
▸ ALDH1A1 P00352 2/20 0.54
▸ PKM P14618 2/20 0.54
▸ KDM4E B2RXH2 5/20 0.53
▸ CTDSP1 Q9GZU7 2/20 0.53
▸ APOBEC3A P31941 1/20 0.53
▸ APOBEC3G Q9HC16 1/20 0.53
▸ CYP1A2 P05177 1/20 0.51
▸ CYP3A4 P08684 1/20 0.51
▸ HPGD P15428 1/20 0.51
▸ TSHR P16473 1/20 0.51
▸ NFKB1 P19838 1/20 0.51
▸ APEX1 P27695 1/20 0.51
▸ BLM P54132 1/20 0.51
▸ PMP22 Q01453 1/20 0.51

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
SCHEMBL10464599 0.87 NPC1 (0.60) NPC1RAB9AMAPTKMT2AMEN1
SCHEMBL10464600 0.87 NPC1 (0.60) NPC1RAB9AMAPTKMT2AMEN1
SCHEMBL10466168 0.86 NPC1 (0.71) NPC1RAB9AMAPTKMT2AMEN1
SCHEMBL10466169 0.86 NPC1 (0.71) NPC1RAB9AMAPTKMT2AMEN1
SCHEMBL6841774 0.85 ALDH1A1 (0.59) NPC1RAB9AMAPTKMT2AMEN1
SCHEMBL10465508 0.85 NPC1 (0.58) NPC1RAB9AMAPTKMT2AMEN1
SCHEMBL10465934 0.85 NPC1 (0.58) NPC1RAB9AMAPTKMT2AMEN1
SCHEMBL10236929 0.82 RAB9A (0.82) NPC1RAB9AMAPTKMT2AMEN1
SCHEMBL11350421 0.82 RAB9A (0.82) NPC1RAB9AMAPTKMT2AMEN1
SCHEMBL19962767 0.81 RAB9A (0.70) NPC1RAB9AMAPTKMT2AMEN1

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-0397746-A1 CONDENSATION POLYMERS CONTAINING METHINE ULTRAVIOLET RADIATION-ABSORBING RESIDUES AND SHAPED ARTICLES PRODUCED THEREFROM EASTMAN KODAK COMPANY (US) 1990-11-22 — — EP disclosed
EP-0326287-A2 Condensation polymers containing methine ultraviolet radiation-absorbing residues and shaped articles produced therefrom EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1989-08-02 — — EP disclosed
WO-1989006663-A1 CONDENSATION POLYMERS CONTAINING METHINE ULTRAVIOLET RADIATION-ABSORBING RESIDUES AND SHAPED ARTICLES PRODUCED THEREFROM EASTMAN KODAK COMPANY (US) 1989-07-27 — — WO disclosed
US-4845187-A POLYESTERS EASTMAN KODAK COMPANY (US) 1989-07-04 — — US disclosed
Send feedback