SCHEMBL27935092

SCHEMBL27935092

Clc1ncccc1-c1cccc(-c2ccccc2)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CTSA P10619 1/20 0.46
▸ DHODH Q02127 4/20 0.45
▸ NPC1 O15118 3/20 0.44
▸ RAB9A P51151 3/20 0.44
▸ MAPT P10636 2/20 0.44
▸ PKM P14618 1/20 0.44
▸ MAP4K4 O95819 1/20 0.43
▸ MEN1 O00255 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ ACLY P53396 1/20 0.40
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ PTGER1 P34995 1/20 0.39
▸ PTGER4 P35408 1/20 0.39
▸ PTGER3 P43115 1/20 0.39
▸ PTGER2 P43116 1/20 0.39
▸ LMNA P02545 1/20 0.39

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
SCHEMBL27945860 0.86 DHODH (0.51) DHODHNPC1RAB9AMAPTPKM
SCHEMBL3327536 0.86 DHODH (0.50) CTSADHODHNPC1RAB9AMAPT
SCHEMBL28357121 0.80 MAP4K4 (0.53) CTSADHODHNPC1RAB9AMAPT
SCHEMBL28827012 0.78 MAP4K4 (0.43) NPC1RAB9AMAPTMAP4K4MEN1
SCHEMBL18188070 0.78 MAP4K4 (0.71) MAP4K4PTGER1PTGER4PTGER3PTGER2
SCHEMBL6170227 0.76 PIP4K2A (0.44) CTSANPC1RAB9AMAP4K4MEN1
SCHEMBL22477643 0.76 MEN1 (0.50) DHODHNPC1RAB9AMAPTPKM
SCHEMBL27998333 0.74 GRM5 (0.50) NPC1RAB9AMAPTPKMSMN1; SMN2
SCHEMBL23759509 0.74 CYP2A6 (0.70) NPC1RAB9ASMN1; SMN2CYP1A2CYP2C9
SCHEMBL27654772 0.74 KDM4E (0.49) DHODHMAPTMAP4K4KDM4ECYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103524510-B The organic electroluminescent device of new organic electroluminescent compounds and this compound of use ROHM & HAAS ELECT MATERIALS (KR) 2016-02-10 — — CN disclosed
CN-105294712-A NOVEL ORGANIC ELECTROLUMINESCENT COMPOUNDS AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME ROHM & HAAS ELECT MAT 2016-02-03 — — CN disclosed
CN-105176523-A Novel organic electroluminescent compounds and organic electroluminescent device using the same DOW ADVANCED DISPLAY MATERIALS 2015-12-23 — — CN disclosed
CN-105001224-A Novel organic electroluminescent compounds and organic electroluminescent device using the same ROHM AND HAAS KOREA CO LTD 2015-10-28 — — CN disclosed
CN-103641830-A Novel organic electroluminescent compounds and organic electroluminescent device using the same ROHM & HAAS ELECT MAT 2014-03-19 — — CN disclosed
CN-103641832-A Novel organic electroluminescent compounds and organic electroluminescent device using the same ROHM & HAAS ELECT MAT 2014-03-19 — — CN disclosed
CN-103641831-A Novel organic electroluminescent compounds and organic electroluminescent device using the same ROHM & HAAS ELECT MAT 2014-03-19 — — CN disclosed
CN-103555322-A Novel organic electroluminescent compounds and organic electroluminescent device using same ROHM & HAAS ELECT MAT 2014-02-05 — — CN disclosed
CN-103524510-A Novel organic electroluminescent compounds and organic electroluminescent device using the same ROHM & HAAS ELECT MAT 2014-01-22 — — CN disclosed
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