SCHEMBL3882497

SCHEMBL3882497

COC(=O)CCc1ccc(OCc2ccc(F)cc2)c(-c2ccc3c(cnn3C)c2)c1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CACNA1H O95180 5/20 0.43
NR3C1 P04150 1/20 0.41
TP53 P04637 3/20 0.41
MDM2 Q00987 3/20 0.41
FFAR4 Q5NUL3 3/20 0.40
FFAR1 O14842 1/20 0.40
AR P10275 3/20 0.40
CCNC P24863 1/20 0.40
CDK8 P49336 1/20 0.40
LRRK2 Q5S007 1/20 0.40
CYP11B1 P15538 1/20 0.39
CYP11B2 P19099 1/20 0.39
NOTUM Q6P988 1/20 0.38
POLQ O75417 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
SCHEMBL3688007 0.92 AR (0.47) TP53MDM2FFAR4FFAR1AR
SCHEMBL3882096 0.91 FFAR4 (0.49) CACNA1HNR3C1TP53MDM2FFAR4
SCHEMBL1014070 0.88 CACNA1H (0.41) CACNA1HNR3C1FFAR4FFAR1AR
SCHEMBL3883507 0.85 CACNA1H (0.41) CACNA1HNR3C1TP53MDM2FFAR4
SCHEMBL3884003 0.84 TP53 (0.51) CACNA1HNR3C1TP53MDM2FFAR4
SCHEMBL3686723 0.83 FFAR4 (0.53) TP53MDM2FFAR4FFAR1AR
SCHEMBL3889102 0.83 FFAR4 (0.50) CACNA1HFFAR4FFAR1ARCCNC
SCHEMBL3881559 0.82 TP53 (0.50) TP53MDM2FFAR4FFAR1AR
SCHEMBL3882496 0.82 PTGER1 (0.43) CACNA1HNR3C1FFAR4ARCCNC
SCHEMBL3882028 0.82 CCNC (0.49) TP53MDM2FFAR4FFAR1CCNC

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 CACNA1H 1216/4885NR3C1 188/4885TP53 4018/4885

“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.