SCHEMBL4989274

SCHEMBL4989274

Cc1ccc(-c2c(C)cccc2C(=O)Nc2ccc3cc(C(=O)OCc4ccccc4)ccc3n2)cc1

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MTTP P55157 10/20 0.46
RAB9A P51151 2/20 0.44
NPC1 O15118 1/20 0.44
DHODH Q02127 3/20 0.44
CYP3A4 P08684 1/20 0.43
RAF1 P04049 2/20 0.40
BRAF P15056 2/20 0.40

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
SCHEMBL4989401 0.92 MTTP (0.51) MTTPCYP3A4
SCHEMBL4986717 0.92 MTTP (0.48) MTTPDHODHCYP3A4
SCHEMBL4990346 0.92 MTTP (0.47) MTTPRAB9ANPC1DHODH
SCHEMBL4986116 0.91 MTTP (0.48) MTTP
SCHEMBL4981792 0.89 MTTP (0.57) MTTPDHODH
SCHEMBL4984065 0.85 NPC1 (0.50) MTTPRAB9ANPC1CYP3A4
SCHEMBL4991624 0.85 MTTP (0.50) MTTPRAB9ANPC1DHODH
SCHEMBL4984087 0.83 MTTP (0.50) MTTPRAB9ANPC1
SCHEMBL4987556 0.81 MTTP (0.59) MTTP
SCHEMBL4981516 0.80 MTTP (0.59) MTTPDHODH

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 8 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
EP-1716137-A1 SUBSTITUTED QUINOLINE COMPOUNDS Pfizer Products Incorporated (US) 2006-11-02 EP 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
WO-2005080373-A1 SUBSTITUTED QUINOLINE COMPOUNDS PFIZER PRODUCTS INC. (US) 2005-09-01 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 (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 9/4885RAB9A 1687/4885NPC1 32/4885
US-20060223851-A1 TRIAMIDE-SUBSTITUTED HETEROBICYCLIC COMPOUNDS APOB, MTPN, CTRB1 MTTP 7/4885RAB9A 2095/4885NPC1 32/4885
US-20070093525-A1 Triamide-substituted heterobicyclic compounds APOB, MTPN, CTRB1 MTTP 7/4885RAB9A 2095/4885NPC1 32/4885

“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.