SCHEMBL4986089

SCHEMBL4986089

COc1cccc(C(=O)Nc2ccc3cc(C(=O)O)ccc3n2)c1-c1ccc(C(C)(C)C)cc1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MTTP P55157 11/20 0.53
NR1H4 Q96RI1 5/20 0.50
PPARG P37231 3/20 0.50
PPARA Q07869 2/20 0.50
PPARD Q03181 1/20 0.45
GPBAR1 Q8TDU6 1/20 0.45
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
RXFP1 Q9HBX9 1/20 0.43
RARA P10276 1/20 0.42
RARB P10826 1/20 0.42
RARG P13631 1/20 0.42
CASP3 P42574 1/20 0.42
SENP7 Q9BQF6 1/20 0.42
SENP6 Q9GZR1 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
SCHEMBL4985584 0.90 RXFP1 (0.48) MTTPNPC1RAB9ARXFP1CASP3
SCHEMBL4990333 0.90 MTTP (0.51) MTTPNPC1RAB9ARXFP1CASP3
SCHEMBL4984087 0.88 MTTP (0.50) MTTPNR1H4PPARGPPARAPPARD
SCHEMBL4982046 0.88 MTTP (0.56) MTTPNR1H4PPARGNPC1RAB9A
SCHEMBL5665951 0.87 MTTP (0.45) MTTPNR1H4PPARGPPARAPPARD
SCHEMBL3175315 0.83 MTTP (0.73) MTTPNR1H4PPARG
SCHEMBL4987220 0.81 MEN1 (0.58) MTTPNR1H4PPARGNPC1RAB9A
SCHEMBL5666303 0.80 MTTP (0.56) MTTP
SCHEMBL4986532 0.80 MTTP (0.49) MTTP
SCHEMBL3239404 0.79 MTTP (0.83) MTTP

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7468378-B2 Substituted quinoline compounds PFIZER INC. (US) 2008-12-23 US disclosed
US-7368573-B2 Triamide-substituted heterobicyclic compounds PFIZER INC. (US) 2008-05-06 US disclosed
US-20060223851-A1 TRIAMIDE-SUBSTITUTED HETEROBICYCLIC COMPOUNDS BERTINATO PETER 2006-10-05 US disclosed
US-20050234099-A1 Substituted quinoline compounds PFIZER INC 2005-10-20 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 (2 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-20050234099-A1 Substituted quinoline compounds APOB, APOL1, MTPN MTTP 9/4885NR1H4 250/4885PPARG 551/4885
US-20060223851-A1 TRIAMIDE-SUBSTITUTED HETEROBICYCLIC COMPOUNDS APOB, MTPN, CTRB1 MTTP 7/4885NR1H4 111/4885PPARG 493/4885

“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.