SCHEMBL3882141

SCHEMBL3882141

CC(C)COc1ccc(CCC(=O)O)cc1-c1ccc2c(cnn2C)c1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 3/20 0.45
CCNC P24863 3/20 0.41
CDK8 P49336 3/20 0.41
AR P10275 5/20 0.41
TP53 P04637 3/20 0.41
MDM2 Q00987 3/20 0.41
FFAR4 Q5NUL3 2/20 0.40
BCL2L1 Q07817 2/20 0.40
MCL1 Q07820 1/20 0.40
FOS P01100 1/20 0.39
JUN P05412 1/20 0.39
S1PR3 Q99500 1/20 0.39
S1PR5 Q9H228 1/20 0.39
USP7 Q93009 1/20 0.38

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
SCHEMBL3888350 0.91 THRA (0.44) S1PR1CCNCCDK8ARTP53
SCHEMBL3884144 0.89 S1PR1 (0.44) S1PR1TP53MDM2FFAR4BCL2L1
SCHEMBL3686723 0.86 FFAR4 (0.53) ARTP53MDM2FFAR4
SCHEMBL3881173 0.86 RXRA (0.44) S1PR1CCNCCDK8ARTP53
SCHEMBL3889102 0.86 FFAR4 (0.50) CCNCCDK8ARFFAR4
SCHEMBL3889412 0.85 TP53 (0.46) CCNCCDK8TP53MDM2FFAR4
SCHEMBL3882096 0.85 FFAR4 (0.49) ARTP53MDM2FFAR4
SCHEMBL3884003 0.85 TP53 (0.51) CCNCCDK8ARTP53MDM2
SCHEMBL3886022 0.85 TP53 (0.43) CCNCCDK8ARTP53MDM2
SCHEMBL3883128 0.84 FFAR1 (0.47) S1PR1CCNCCDK8ARTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1477472-B1 SUBSTITUTED PHENYLALKANOIC ACID DERIVATIVE AND USE THEREOF ASAHI KASEI PHARMA CORP (JP) 2009-01-14 EP claimed
US-6867320-B2 Substituted phenylalkanoic acid derivatives and use thereof ASAHI KASEI PHARMA CORPORATION (JP) 2005-03-15 US claimed
EP-1477472-A1 SUBSTITUTED PHENYLALKANOIC ACID DERIVATIVE AND USE THEREOF Asahi Kasei Pharma Corporation (JP) 2004-11-17 EP claimed
US-20040044258-A1 Substituted phenylalkanoic acid derivatives and use thereof ASAHI KASEI PHARMA CORPORATION (JP) 2004-03-04 US claimed
EP-1477472-B1 SUBSTITUTED PHENYLALKANOIC ACID DERIVATIVE AND USE THEREOF ASAHI KASEI PHARMA CORP (JP) 2009-01-14 EP disclosed
US-6867320-B2 Substituted phenylalkanoic acid derivatives and use thereof ASAHI KASEI PHARMA CORPORATION (JP) 2005-03-15 US disclosed
EP-1477472-A1 SUBSTITUTED PHENYLALKANOIC ACID DERIVATIVE AND USE THEREOF Asahi Kasei Pharma Corporation (JP) 2004-11-17 EP disclosed
US-20040044258-A1 Substituted phenylalkanoic acid derivatives and use thereof ASAHI KASEI PHARMA CORPORATION (JP) 2004-03-04 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040044258-A1 Substituted phenylalkanoic acid derivatives and use thereof PTGER1, CYSLTR1, PTGS1 S1PR1 77/4885CCNC 2174/4885CDK8 3600/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.