SCHEMBL14710209

SCHEMBL14710209

O=C(O)c1ccn(-c2ccc(-c3ccc(C4(C(=O)O)CC4)cc3)cc2)n1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ELOVL1 Q9BW60 6/20 0.46
LPAR1 Q92633 9/20 0.40
KMT2A Q03164 1/20 0.39
CYP2C9 P11712 2/20 0.39
APP P05067 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C19 P33261 1/20 0.39
MAP4K4 O95819 1/20 0.38
HRH1 P35367 1/20 0.37
AKR1C1 Q04828 1/20 0.37

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
SCHEMBL14710193 0.86 ELOVL1 (0.44) ELOVL1LPAR1KMT2A
SCHEMBL14790230 0.84 ELOVL1 (0.38) ELOVL1KMT2ACYP2C9
SCHEMBL349537 0.76 NPC1 (0.54) ELOVL1KMT2ACYP2C9APPCYP2C19
SCHEMBL14790223 0.75 NPC1 (0.44) KMT2ACYP2C9
SCHEMBL31031032 0.73 KMT2A (0.45) KMT2ACYP2C9
SCHEMBL1063920 0.72 CYP2C9 (0.61) ELOVL1KMT2ACYP2C9
SCHEMBL14794829 0.72 OPRM1 (0.41) ELOVL1
SCHEMBL350760 0.71 KDM4E (0.47) ELOVL1KMT2AAKR1C1
SCHEMBL14150735 0.71 KMT2A (0.64) KMT2ACYP2C9
SCHEMBL15754423 0.71 RPA1 (0.50) KMT2ACYP2C9

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 ELOVL1 268/4885LPAR1 1/4885KMT2A 2450/4885

“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.