SCHEMBL4263524

SCHEMBL4263524

CCCCc1ccccn1.COCCC#N

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 2/20 0.42
HPGD P15428 1/20 0.41
HSD17B10 Q99714 1/20 0.41
NAAA Q02083 1/20 0.40
HRH3 Q9Y5N1 2/20 0.40
LMNA P02545 1/20 0.39
TAAR1 Q96RJ0 1/20 0.39
ALDH1A1 P00352 1/20 0.39
ALOX15 P16050 1/20 0.39
CYP2D6 P10635 2/20 0.38
CYP2C9 P11712 2/20 0.38
CYP1A2 P05177 2/20 0.38
CYP2C19 P33261 2/20 0.38
CYP19A1 P11511 1/20 0.38
CYP3A4 P08684 1/20 0.38
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA9 Q16790 1/20 0.38
ATM Q13315 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
SCHEMBL29582320 0.80 HRH1 (0.60) HRH1NAAAHRH3LMNATAAR1
SCHEMBL64052 0.80 HRH1 (0.60) HRH1NAAAHRH3LMNATAAR1
SCHEMBL6859512 0.78 HRH1 (0.55) HRH1NAAAHRH3LMNATAAR1
SCHEMBL11653759 0.78 ATM (0.56) HRH1NAAAHRH3LMNATAAR1
Ammonia Solution, Strong SCHEMBL6014459 0.78 HRH1 (0.58) HRH1NAAAHRH3LMNATAAR1
Hydrochloric Acid SCHEMBL29039292 0.78 HRH1 (0.58) HRH1NAAAHRH3LMNATAAR1
Hydrochloric Acid SCHEMBL30395582 0.78 HRH1 (0.58) HRH1NAAAHRH3LMNATAAR1
Hydrochloric Acid SCHEMBL30887885 0.78 HRH1 (0.58) HRH1NAAAHRH3LMNATAAR1
Bromide SCHEMBL28377567 0.78 HRH1 (0.58) HRH1NAAAHRH3LMNATAAR1
SCHEMBL28143532 0.78 HRH1 (0.58) HRH1NAAAHRH3LMNATAAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1606845-A4 PHOTOVOLTAIC CELLS UTILIZING MESH ELECTRODES KONARKA TECHNOLOGIES INC (US) 2009-05-27 EP disclosed
EP-1606845-A2 PHOTOVOLTAIC CELLS UTILIZING MESH ELECTRODES Konarka Technologies, Inc. (US) 2005-12-21 EP disclosed
WO-2004086464-A2 PHOTOVOLTAIC CELLS UTILIZING MESH ELECTRODES KONARKA TECHNOLOGIES, INC. (US) 2004-10-07 WO disclosed