SCHEMBL3229098

SCHEMBL3229098

CCCCCC(CCCCC)CCCN1CCCCC1

nearest known ligand 0.67

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.48
GNAI3 P08754 3/20 0.41
GNAO1 P09471 3/20 0.41
GNAI1 P63096 3/20 0.41
LTA4H P09960 1/20 0.41
MAPT P10636 1/20 0.39
LMNA P02545 1/20 0.39
KDM4E B2RXH2 1/20 0.39
CYP1A2 P05177 1/20 0.38
MAPK1 P28482 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
BCHE P06276 1/20 0.38
ALDH1A1 P00352 1/20 0.37

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
SCHEMBL22857557 0.90 HRH3 (0.46) HRH3GNAI3GNAO1GNAI1LTA4H
SCHEMBL22857504 0.89 HRH3 (0.45) HRH3GNAI3GNAO1GNAI1LTA4H
SCHEMBL21392491 0.88 LTA4H (0.45) HRH3GNAI3GNAO1GNAI1LTA4H
SCHEMBL19185581 0.88 LTA4H (0.45) HRH3GNAI3GNAO1GNAI1LTA4H
SCHEMBL19185652 0.88 LTA4H (0.45) HRH3GNAI3GNAO1GNAI1LTA4H
SCHEMBL19185641 0.88 LTA4H (0.45) HRH3GNAI3GNAO1GNAI1LTA4H
SCHEMBL27373431 0.88 GNAI3 (0.53) GNAI3GNAO1GNAI1LMNAKDM4E
SCHEMBL21361903 0.86 LTA4H (0.40) HRH3GNAI3GNAO1GNAI1LTA4H
SCHEMBL19185680 0.86 LTA4H (0.44) HRH3GNAI3GNAO1GNAI1LTA4H
SCHEMBL25064562 0.84 LMNA (0.43) HRH3GNAI3GNAO1GNAI1LTA4H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100178333-A1 SUSTAINED RELEASE DOSAGE FORM OF PHENOTHIAZINE DERIVATIVES CONTAINING CHANNELIZER ASTRON RESEARCH LIMITED (IN) 2010-07-15 US disclosed
EP-1976487-A2 SUSTAINED RELEASE DOSAGE FORM OF PHENOTHIAZINE DERIVATIVES CONTAINING CHANNELIZER Astron Research Limited (IN) 2008-10-08 EP disclosed
WO-2007086079-A2 SUSTAINED RELEASE DOSAGE FORM OF PHENOTHIAZINE DERIVATIVES CONTAINING CHANNELIZER ASTRON RESEARCH LIMITED (IN) 2007-08-02 WO disclosed
US-4933346-A CARDIOVASCULAR AND CEREBROVASCULAR DISORDERS HOECHST AKTIENGESELLSCHAFT (DE) 1990-06-12 US disclosed
US-4918073-A CALCIUM ANTAGONISTS HOECHST AKTIENGESELLSCHAFT (DE) 1990-04-17 US disclosed