SCHEMBL14711278

SCHEMBL14711278

CCOC(=O)Cn1ccc2cc(-c3ccc(B4OC(C)(C)C(C)(C)O4)cc3)ccc21

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ LIPG Q9Y5X9 7/20 0.44
▸ LPL P06858 6/20 0.44
▸ NTSR1 P30989 2/20 0.39
▸ ATM Q13315 1/20 0.35
▸ ALDH1A1 P00352 2/20 0.34
▸ SNCA P37840 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ MTNR1A P48039 1/20 0.34
▸ MTNR1B P49286 1/20 0.34
▸ SCN9A Q15858 1/20 0.34
▸ UCHL1 P09936 1/20 0.34
▸ KEAP1 Q14145 1/20 0.34
▸ NFE2L2 Q16236 1/20 0.34

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
SCHEMBL14711087 0.91 ATM (0.38) LIPGLPLATMALDH1A1MTNR1A
SCHEMBL14947704 0.81 NTSR1 (0.57) NTSR1ALDH1A1RAB9AKDM4E
SCHEMBL20604796 0.80 ATM (0.48) LIPGNTSR1ATMMTNR1AMTNR1B
SCHEMBL14790350 0.80 LIPG (0.52) LIPGLPLSNCASCN9A
SCHEMBL14711276 0.80 NTSR1 (0.45) NTSR1ATMALDH1A1RAB9ASMN1; SMN2
SCHEMBL19510666 0.79 TNF (0.48) MTNR1AMTNR1B
SCHEMBL20605103 0.76 KMT2A (0.48) LIPGLPLNTSR1
SCHEMBL20604867 0.76 GRIN2B (0.40) —
SCHEMBL762261 0.75 F11 (0.39) LIPGLPLNTSR1
SCHEMBL12989381 0.74 LIPG (0.50) LIPGLPLKEAP1NFE2L2

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 LIPG 97/4885LPL 111/4885NTSR1 272/4885

“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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