SCHEMBL16104960

SCHEMBL16104960

CCCn1c2ccc(CC=O)cc2c2c(F)cccc21

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ PTGER4 P35408 2/20 0.57
▸ CRY1 Q16526 4/20 0.40
▸ CRY2 Q49AN0 4/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ TP53 P04637 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ CNR2 P34972 6/20 0.36
▸ PER2 O15055 2/20 0.36
▸ RORC P51449 2/20 0.36
▸ PGR P06401 2/20 0.36
▸ RORA P35398 1/20 0.36
▸ RORB Q92753 1/20 0.36
▸ ICMT O60725 1/20 0.36
▸ CNR1 P21554 1/20 0.36
▸ NPC1 O15118 1/20 0.34

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
SCHEMBL16099114 0.85 ALDH1A1 (0.42) PTGER4ALDH1A1HPGDMAPTCNR2
SCHEMBL16093825 0.83 PGR (0.41) PTGER4ALDH1A1HPGDTP53MAPT
SCHEMBL16093698 0.81 ALDH1A1 (0.58) PTGER4ALDH1A1HPGDTP53MAPT
SCHEMBL16104959 0.78 HPGD (0.54) PTGER4CRY1CRY2ALDH1A1HPGD
SCHEMBL16099561 0.75 KDM4E (0.47) ALDH1A1HPGDMAPTCNR2RORC
SCHEMBL16093752 0.75 HPGD (0.44) ALDH1A1HPGDMAPTSMN1; SMN2CNR2
SCHEMBL16097572 0.75 ALDH1A1 (0.44) ALDH1A1HPGDTP53MAPTSMN1; SMN2
SCHEMBL15774378 0.73 PTGER4 (1.00) PTGER4CRY1CRY2ALDH1A1HPGD
SCHEMBL16099757 0.73 PTGER4 (0.54) PTGER4ALDH1A1HPGDMAPTCNR2
SCHEMBL16093634 0.71 MAPT (0.53) MAPTCNR2CNR1

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
WO-2014153043-A1 COMPOUNDS AND METHODS FOR TREATING CANCERS HEALTH RESEARCH, INC. (US) 2014-09-25 — — WO disclosed
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