SCHEMBL7546748

SCHEMBL7546748

O=C(NCc1ccc(Cl)cc1)C1CCCN1

nearest known ligand 0.77

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 6/20 0.77
HTR2B P41595 3/20 0.70
KDM4E B2RXH2 1/20 0.58
NPC1 O15118 1/20 0.51
RAB9A P51151 1/20 0.51
EPHX1 P07099 1/20 0.51
HDAC1 Q13547 3/20 0.51
GID4 Q8IVV7 1/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
HTR2A P28223 1/20 0.49
HDAC3 O15379 2/20 0.48
HDAC2 Q92769 1/20 0.48

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
SCHEMBL15126141 1.00 HTR2C (0.77) HTR2CHTR2BKDM4ENPC1RAB9A
SCHEMBL7548757 0.96 HTR2C (0.71) HTR2CHTR2BKDM4ENPC1RAB9A
SCHEMBL30604550 0.89 HTR2C (0.81) HTR2CHTR2BKDM4ENPC1RAB9A
Hydrochloric Acid SCHEMBL30001608 0.88 HTR2C (0.80) HTR2CHTR2BKDM4ENPC1RAB9A
SCHEMBL21540823 0.87 HTR2C (0.60) HTR2CHTR2BKDM4ENPC1RAB9A
SCHEMBL24653087 0.86 HTR2C (0.70) HTR2CHTR2BKDM4ERAB9AHDAC1
SCHEMBL17268026 0.86 HTR2C (0.70) HTR2CHTR2BKDM4EHDAC1GID4
SCHEMBL21206860 0.86 HTR2C (0.70) HTR2CHTR2BKDM4ERAB9AHDAC1
SCHEMBL30524847 0.86 HTR2C (0.70) HTR2CHTR2BKDM4EHDAC1GID4
SCHEMBL24648976 0.86 HTR2C (0.70) HTR2CHTR2BKDM4EHDAC1GID4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3608317-A1 COMPOUNDS & METHODS FOR THE ENHANCED DEGRADATION OF TARGETED PROTEINS & OTHER POLYPEPTIDES BY AN E3 UBIQUITIN LIGASE Yale University (US) 2020-02-12 EP disclosed
EP-0826673-B1 ACETAMIDE DERIVATIVES, PROCESS FOR PRODUCING THE SAME, AND MEDICINAL COMPOSITION CONTAINING THE SAME DAINIPPON PHARMACEUTICAL CO (JP) 2002-11-20 EP disclosed
US-5972946-A NERVOUS SYSTEM DISORDERS; PSYCHOLOGICAL DISORDERS DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 1999-10-26 US disclosed
EP-0826673-A1 ACETAMIDE DERIVATIVES, PROCESS FOR PRODUCING THE SAME, AND MEDICINAL COMPOSITION CONTAINING THE SAME DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 1998-03-04 EP disclosed