SCHEMBL14710437

SCHEMBL14710437

Cc1ccc2c(NC(=O)OCc3ccccc3)c(-c3ccc(-c4ccc(C5(C(=O)O)CC5)cc4)cc3)oc2n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 5/20 0.46
CYP2C9 P11712 2/20 0.46
ABCC3 O15438 1/20 0.46
ABCC4 O15439 1/20 0.46
ABCB11 O95342 1/20 0.46
CYP2C8 P10632 1/20 0.46
ABCB4 P21439 1/20 0.46
ABCC2 Q92887 1/20 0.46
SLCO1B3 Q9NPD5 1/20 0.46
SLCO1B1 Q9Y6L6 1/20 0.46
MAOA P21397 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.39
MGLL Q99685 2/20 0.38
ALDH1A1 P00352 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
TSHR P16473 1/20 0.38
CYP2C19 P33261 1/20 0.38
HSD17B10 Q99714 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
SCHEMBL14710485 0.90 ABCC3 (0.43) LPAR1CYP2C9ABCC3ABCC4ABCB11
SCHEMBL14710476 0.90 LPAR1 (0.42) LPAR1CYP2C9ABCC3ABCC4ABCB11
SCHEMBL14710441 0.87 MGLL (0.41) LPAR1CYP2C9ABCC3ABCC4ABCB11
SCHEMBL14788984 0.87 MAOA (0.39) LPAR1CYP2C9ABCC3ABCC4ABCB11
SCHEMBL14710486 0.85 LPAR1 (0.45) LPAR1CYP2C9ABCC3ABCC4ABCB11
SCHEMBL14711305 0.84 LPAR1 (0.67) LPAR1CYP2C9ABCC3ABCC4ABCB11
SCHEMBL14794080 0.82 LPAR1 (0.41) LPAR1CYP2C9ABCC3ABCC4ABCB11
SCHEMBL14710413 0.81 ABCC3 (0.41) LPAR1CYP2C9ABCC3ABCC4ABCB11
SCHEMBL14710477 0.81 MGLL (0.43) LPAR1CYP2C9ABCC3ABCC4ABCB11
SCHEMBL14794060 0.80 LPAR1 (0.54) LPAR1CYP2C9ABCC3ABCC4ABCB11

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
US-8975235-B2 Lysophosphatidic acid receptor antagonists INTERMUNE, INC. (US) 2015-03-10 US disclosed
US-20130072449-A1 LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISTS INTERMUNE, INC. (US) 2013-03-21 US disclosed
WO-2013025733-A1 LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISTS INTERMUNE, INC. (US) 2013-02-21 WO 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-20130072449-A1 LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISTS LPAR1, LPAR2, LPAR5 LPAR1 1/4885CYP2C9 4744/4885ABCC3 2708/4885

“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.