SCHEMBL4982046

SCHEMBL4982046

Cc1cccc(C(=O)Nc2ccc3cc(C(=O)O)ccc3n2)c1-c1ccc(C(C)(C)C)cc1

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MTTP P55157 7/20 0.56
▸ PPARG P37231 5/20 0.48
▸ TP53 P04637 1/20 0.46
▸ THRB P10828 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ MEN1 O00255 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ CYP3A4 P08684 1/20 0.45
▸ NR1H4 Q96RI1 6/20 0.45
▸ EPHX2 P34913 1/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ RAB9A P51151 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
SCHEMBL4986532 0.91 MTTP (0.49) MTTPTHRBCYP3A4
SCHEMBL4984065 0.90 NPC1 (0.50) MTTPCYP3A4NPC1RAB9A
SCHEMBL4986089 0.88 MTTP (0.53) MTTPPPARGNR1H4NPC1RAB9A
SCHEMBL4984140 0.86 MTTP (0.49) MTTPCYP3A4NPC1RAB9A
SCHEMBL4989401 0.86 MTTP (0.51) MTTPPPARGTP53THRBSMN1; SMN2
SCHEMBL3175315 0.85 MTTP (0.73) MTTPPPARGNR1H4
SCHEMBL5665951 0.85 MTTP (0.45) MTTPPPARGMEN1KMT2ANR1H4
SCHEMBL4987220 0.83 MEN1 (0.58) MTTPPPARGTP53SMN1; SMN2MEN1
SCHEMBL5666303 0.83 MTTP (0.56) MTTP
SCHEMBL4981961 0.79 MTTP (0.60) MTTPPPARGMEN1KMT2ANR1H4

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 6 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-7393958-B2 Triamide-substituted heterobicyclic compounds PFIZER, INC. (US) 2008-07-01 — — US disclosed
US-7368573-B2 Triamide-substituted heterobicyclic compounds PFIZER INC. (US) 2008-05-06 — — US disclosed
US-20070093525-A1 Triamide-substituted heterobicyclic compounds PFIZER INC 2007-04-26 — — 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 (3 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 9/4885PPARG 551/4885TP53 3211/4885
US-20060223851-A1 TRIAMIDE-SUBSTITUTED HETEROBICYCLIC COMPOUNDS APOB, MTPN, CTRB1 MTTP 7/4885PPARG 493/4885TP53 4013/4885
US-20070093525-A1 Triamide-substituted heterobicyclic compounds APOB, MTPN, CTRB1 MTTP 7/4885PPARG 493/4885TP53 4013/4885

“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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