SCHEMBL19673668

SCHEMBL19673668

Nc1ccc2c(c1)-c1ccc(-c3ccccc3)cc1C2

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 3/20 0.62
▸ LMNA P02545 2/20 0.62
▸ MAPT P10636 2/20 0.62
▸ NPC1 O15118 2/20 0.62
▸ ALDH1A1 P00352 2/20 0.62
▸ SMN1; SMN2 Q16637 2/20 0.62
▸ KDM4E B2RXH2 1/20 0.62
▸ HPGD P15428 1/20 0.62
▸ TDP2 O95551 3/20 0.50
▸ MAOA P21397 1/20 0.47
▸ CYP3A4 P08684 2/20 0.47
▸ TDP1 Q9NUW8 2/20 0.47
▸ TAAR1 Q96RJ0 1/20 0.47
▸ HSD17B10 Q99714 1/20 0.47
▸ MMP12 P39900 1/20 0.42
▸ MMP13 P45452 1/20 0.42
▸ MEN1 O00255 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ TLR9 Q9NR96 1/20 0.41
▸ PARP10 Q53GL7 1/20 0.41

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
SCHEMBL19847551 0.93 LMNA (0.67) RAB9ALMNAMAPTNPC1ALDH1A1
SCHEMBL7139324 0.85 TDP2 (0.58) RAB9ALMNAMAPTNPC1ALDH1A1
SCHEMBL29569358 0.85 TDP2 (0.61) RAB9ALMNAMAPTNPC1ALDH1A1
SCHEMBL3136254 0.85 TDP2 (0.61) RAB9ALMNAMAPTNPC1ALDH1A1
SCHEMBL1482920 0.85 TDP2 (0.61) RAB9ALMNAMAPTNPC1ALDH1A1
SCHEMBL1482804 0.83 MAPT (0.57) RAB9ALMNAMAPTNPC1ALDH1A1
SCHEMBL30172496 0.83 MAPT (0.57) RAB9ALMNAMAPTNPC1ALDH1A1
SCHEMBL1666630 0.83 MAPT (0.57) RAB9ALMNAMAPTNPC1ALDH1A1
SCHEMBL30831157 0.83 TDP2 (0.59) RAB9ALMNAMAPTNPC1ALDH1A1
SCHEMBL19847534 0.83 KDM4E (0.68) RAB9ALMNAMAPTNPC1ALDH1A1

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
EP-3131901-B1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2018-02-07 — — EP disclosed
EP-3114102-B1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2017-12-06 — — EP disclosed
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