SCHEMBL12400797

SCHEMBL12400797

Cc1ccc(CCC(CCc2ccc(C)cc2)C(=O)O)cc1

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ FFAR1 O14842 2/20 0.47
▸ TDP1 Q9NUW8 1/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.47
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ CYP1A2 P05177 1/20 0.43
▸ CYP2A6 P11509 1/20 0.43
▸ TAAR1 Q96RJ0 1/20 0.43
▸ DPP4 P27487 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.42
▸ CTBP2 P56545 1/20 0.42
▸ SRD5A2 P31213 1/20 0.42
▸ ANPEP P15144 1/20 0.42

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
SCHEMBL10327379 0.91 CPA3 (0.50) FFAR1CYP1A2ANPEP
SCHEMBL5368777 0.89 CYP1A2 (0.47) FFAR1TDP1L3MBTL1CYP1A2CYP2A6
SCHEMBL17590311 0.82 TSHR (0.50) FFAR1TDP1L3MBTL1SMN1; SMN2CYP1A2
SCHEMBL11825954 0.82 S1PR2 (0.47) FFAR1TDP1L3MBTL1SMN1; SMN2CYP1A2
SCHEMBL25181550 0.82 TSHR (0.50) FFAR1TDP1L3MBTL1SMN1; SMN2CYP1A2
SCHEMBL1857365 0.81 CYP1A2 (0.61) CYP1A2ANPEP
SCHEMBL16315019 0.81 CYP1A2 (0.45) FFAR1TDP1L3MBTL1SMN1; SMN2CYP1A2
SCHEMBL16148061 0.81 KIF11 (0.54) FFAR1TDP1L3MBTL1CYP1A2CYP2A6
SCHEMBL11827938 0.81 FFAR1 (0.45) FFAR1TDP1L3MBTL1SMN1; SMN2CYP1A2
SCHEMBL16148063 0.81 KIF11 (0.54) FFAR1TDP1L3MBTL1CYP1A2CYP2A6

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
US-7985876-B2 Substituted dibenzoic acid derivatives and use thereof BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2011-07-26 — — US disclosed
US-20100168240-A1 SUBSTITUTED DIBENZOIC ACID DERIVATIVES AND USE THEREOF BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2010-07-01 — — 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-20100168240-A1 SUBSTITUTED DIBENZOIC ACID DERIVATIVES AND USE THEREOF BBOX1, DDC, DDT FFAR1 417/4885TDP1 1039/4885L3MBTL1 2527/4885

“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.

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