SCHEMBL27340992

SCHEMBL27340992

O=C(CC1CCNN1)c1ccc(F)cc1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 2/20 0.47
HTR2A P28223 2/20 0.47
HTR2C P28335 2/20 0.47
HTR2B P41595 2/20 0.47
SIGMAR1 Q99720 2/20 0.47
PTPN1 P18031 1/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
HTR7 P34969 1/20 0.39
PLOD2 O00469 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
SCHEMBL465900 0.75 CHRM3 (0.47) DRD2HTR2AHTR2CHTR2BSIGMAR1
SCHEMBL5469826 0.74 DRD2 (0.73) DRD2HTR2AHTR2CHTR2BSIGMAR1
SCHEMBL948505 0.74 DRD2 (0.60) DRD2HTR2AHTR2CHTR2BSIGMAR1
Hydrochloric Acid SCHEMBL11098055 0.73 DRD2 (0.58) DRD2HTR2AHTR2CHTR2BSIGMAR1
SCHEMBL5473682 0.72 DRD2 (0.54) DRD2HTR2AHTR2CHTR2BSIGMAR1
SCHEMBL6611458 0.71 DRD2 (0.65) DRD2HTR2AHTR2CHTR2BSIGMAR1
Hydrochloric Acid SCHEMBL7225414 0.71 DRD2 (0.52) DRD2HTR2AHTR2CHTR2BSIGMAR1
SCHEMBL14784803 0.70 DRD2 (0.63) DRD2HTR2AHTR2CHTR2BSIGMAR1
SCHEMBL9870657 0.70 KMT2A (0.55) DRD2HTR2AHTR2CHTR2BSIGMAR1
SCHEMBL13517233 0.68 SIGMAR1 (0.46) DRD2HTR2AHTR2CHTR2BSIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1060772-C New Indole, Indazole and benzisoxazole compounds, their process of preparation and pharmaceutical compositions which contain them ADIR (FR) 2001-01-17 CN disclosed
CN-1143642-A New indole, indazole and benzisoxazole compounds, their process of preparation and pharmaceutical compositions which contain them ADIR (FR) 1997-02-26 CN disclosed