SCHEMBL11803485

SCHEMBL11803485

CCc1cccc(C2(O)CCN(CCCCN3C(=O)c4cccc5cccc(c45)C3=O)CC2)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DRD2 P14416 7/20 0.49
▸ HTR1A P08908 6/20 0.49
▸ HTR2A P28223 6/20 0.49
▸ HTR6 P50406 6/20 0.49
▸ HTR7 P34969 5/20 0.49
▸ DRD3 P35462 1/20 0.48
▸ MEN1 O00255 2/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ KDM4E B2RXH2 3/20 0.46
▸ LMNA P02545 2/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ HEXA P06865 1/20 0.46
▸ HEXB P07686 1/20 0.46
▸ POLB P06746 2/20 0.44
▸ RXFP1 Q9HBX9 1/20 0.44
▸ RAD52 P43351 2/20 0.44
▸ NR1I2 O75469 1/20 0.44
▸ AHR P35869 1/20 0.44
▸ RCE1 Q9Y256 1/20 0.44
▸ SIGMAR1 Q99720 1/20 0.44

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
SCHEMBL11630376 0.86 DRD2 (0.55) DRD2HTR1AHTR2AHTR6HTR7
SCHEMBL11804225 0.85 DRD2 (0.57) DRD2HTR1AHTR2AHTR6HTR7
SCHEMBL11807499 0.85 DRD2 (0.57) DRD2HTR1AHTR2AHTR6HTR7
SCHEMBL11811290 0.84 KDM4E (0.55) DRD2HTR1AHTR2AHTR6HTR7
SCHEMBL11811302 0.83 MAPK1 (0.56) DRD2HTR1AHTR2AHTR6HTR7
SCHEMBL11809981 0.83 DRD2 (0.55) DRD2HTR1AHTR2AHTR6HTR7
SCHEMBL11808504 0.81 CCR3 (0.56) DRD2HTR1AHTR2AHTR6HTR7
SCHEMBL11629858 0.80 L3MBTL1 (0.44) MEN1KMT2AKDM4ELMNAPOLB
SCHEMBL11628444 0.80 RAD52 (0.58) MEN1KMT2AKDM4ELMNAHEXA
SCHEMBL11811153 0.78 DRD2 (0.53) DRD2HTR1AHTR2AHTR6HTR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-3935227-A ANTIDEPRESSANTS, ANTIANXIETY, ANTIINFLAMMATORY AGENTS E. R. SQUIBB & SONS, INC. (US) 1976-01-27 — — US disclosed
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