SCHEMBL24670558

SCHEMBL24670558

Nc1ccc(C2=CCNCC2)c(F)c1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 3/20 0.46
HTR2C P28335 7/20 0.46
ALOX5AP P20292 1/20 0.46
FEN1 P39748 1/20 0.46
SIGMAR1 Q99720 2/20 0.43
QDPR P09417 2/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPT P10636 1/20 0.41
DRD2 P14416 1/20 0.41
ALOX15 P16050 1/20 0.41
HSD17B10 Q99714 1/20 0.41
HTR1A P08908 1/20 0.41
HTR7 P34969 1/20 0.41

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
Hydrochloric Acid SCHEMBL29882492 0.83 HTR6 (0.50) HTR6HTR2CSIGMAR1QDPRDRD2
SCHEMBL1513540 0.83 HTR6 (0.50) HTR6HTR2CSIGMAR1QDPRDRD2
SCHEMBL19212311 0.82 HTR2C (0.41) HTR6HTR2CALOX5APFEN1SIGMAR1
SCHEMBL26938532 0.81 DRD2 (0.49) HTR6HTR2CALOX5APFEN1SIGMAR1
SCHEMBL23291524 0.81 HTR2C (0.60) HTR6HTR2CALOX5APFEN1SIGMAR1
SCHEMBL24670969 0.81 HTR2C (0.51) HTR6HTR2CSIGMAR1QDPRKDM4E
SCHEMBL31223007 0.81 HTR2C (0.60) HTR6HTR2CALOX5APFEN1SIGMAR1
SCHEMBL14320492 0.81 HTR2C (0.46) HTR6HTR2CSIGMAR1QDPRKDM4E
SCHEMBL24670167 0.80 GLA (0.54) HTR6HTR2CALOX5APFEN1SIGMAR1
SCHEMBL30928085 0.78 HTR6 (0.59) HTR6HTR2CALOX5APFEN1SIGMAR1

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
WO-2022192162-A1 NOVEL HETEROAROMATIC COMPOUNDS EXHIBITING ANTIFUNGAL ACTIVITY AND THEIR METHOD OF USE FOX CHASE CHEMICAL DIVERSITY CENTER, INC. (US) 2022-09-15 WO disclosed
CN-1072222-C Phenyloxazolidinones having a C-C bond to 4-8 membered heterocyclic rings UPJOHN CO (US) 2001-10-03 CN disclosed
CN-1197457-A Phenyloxazolidinones having a C-C bond to a 4-8 membered heterocyclic ring UPJOHN CO (US) 1998-10-28 CN disclosed