SCHEMBL13372976

SCHEMBL13372976

C/C(C#N)=C\C=C(c1ccc(N(C)C)cc1)c1ccc(N(C)C)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 7/20 0.46
▸ ALDH1A1 P00352 6/20 0.46
▸ MEN1 O00255 4/20 0.46
▸ KMT2A Q03164 4/20 0.46
▸ RAB9A P51151 4/20 0.43
▸ MAPK1 P28482 3/20 0.43
▸ APP P05067 2/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ HPGD P15428 2/20 0.41
▸ ALOX15 P16050 2/20 0.40
▸ TSHR P16473 2/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ HBB P68871 1/20 0.40
▸ KDM4E B2RXH2 2/20 0.40
▸ PDE4A P27815 1/20 0.39
▸ PDE4B Q07343 1/20 0.39
▸ PDE4C Q08493 1/20 0.39
▸ PDE4D Q08499 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.38
▸ NPC1 O15118 2/20 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
SCHEMBL9815915 0.83 ALDH1A1 (0.56) MAPTALDH1A1MEN1KMT2ARAB9A
SCHEMBL13372961 0.80 ALDH1A1 (0.48) MAPTALDH1A1MEN1KMT2ARAB9A
SCHEMBL2945263 0.78 PDE4A (0.41) MAPTALDH1A1MEN1KMT2ARAB9A
SCHEMBL2945266 0.78 PDE4A (0.41) MAPTALDH1A1MEN1KMT2ARAB9A
SCHEMBL10306185 0.76 KDM4E (0.51) MAPTALDH1A1MEN1KMT2ARAB9A
SCHEMBL8184701 0.76 RAB9A (0.62) MAPTALDH1A1MEN1KMT2ARAB9A
SCHEMBL8153005 0.76 RAB9A (0.62) MAPTALDH1A1MEN1KMT2ARAB9A
SCHEMBL8153001 0.76 RAB9A (0.62) MAPTALDH1A1MEN1KMT2ARAB9A
SCHEMBL13193947 0.75 APP (0.65) MAPTALDH1A1MEN1KMT2ARAB9A
SCHEMBL4817785 0.74 PDE4A (0.59) MAPTALDH1A1MEN1KMT2ARAB9A

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-8287767-B2 Amorphous polymers with pendant chromogenic groups E.I. DU PONT DE NEMOURS AND COMPANY (US) 2012-10-16 — — US disclosed
US-20090279160-A1 AMORPHOUS POLYMERS WITH PENDANT CHROMOGENIC GROUPS E. I. DUPONT DE NEMOURS AND COMPANY (US) 2009-11-12 — — US disclosed
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