SCHEMBL4984065

SCHEMBL4984065

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

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.50
RAB9A P51151 5/20 0.50
CYP3A4 P08684 1/20 0.48
MTTP P55157 5/20 0.46
KDM4E B2RXH2 2/20 0.46
TDP1 Q9NUW8 1/20 0.46
ALDH1A1 P00352 1/20 0.44
GAA P10253 1/20 0.44
MAPT P10636 1/20 0.44
HPGD P15428 1/20 0.44
MTOR P42345 1/20 0.43
SORT1 Q99523 3/20 0.42
APOB P04114 1/20 0.41
DPP4 P27487 1/20 0.40
GRM5 P41594 1/20 0.40
RARB P10826 1/20 0.39
RARG P13631 1/20 0.39

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
SCHEMBL4982046 0.90 MTTP (0.56) NPC1RAB9ACYP3A4MTTP
SCHEMBL4984140 0.90 MTTP (0.49) NPC1RAB9ACYP3A4MTTPMTOR
SCHEMBL4986532 0.89 MTTP (0.49) CYP3A4MTTPMAPTSORT1APOB
SCHEMBL4985584 0.88 RXFP1 (0.48) NPC1RAB9AMTTPKDM4ETDP1
SCHEMBL4989274 0.85 MTTP (0.46) NPC1RAB9ACYP3A4MTTP
SCHEMBL4987243 0.85 MTTP (0.60) NPC1RAB9AMTTPKDM4ETDP1
SCHEMBL4983839 0.85 NPC1 (0.63) NPC1RAB9ACYP3A4MAPTHPGD
SCHEMBL5665951 0.82 MTTP (0.45) RAB9AMTTPKDM4ETDP1APOB
SCHEMBL4990333 0.80 MTTP (0.51) NPC1RAB9AMTTPKDM4ETDP1
SCHEMBL4986089 0.78 MTTP (0.53) NPC1RAB9AMTTPRARBRARG

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 NPC1 32/4885RAB9A 1687/4885CYP3A4 744/4885
US-20060223851-A1 TRIAMIDE-SUBSTITUTED HETEROBICYCLIC COMPOUNDS APOB, MTPN, CTRB1 NPC1 32/4885RAB9A 2095/4885CYP3A4 1004/4885
US-20070093525-A1 Triamide-substituted heterobicyclic compounds APOB, MTPN, CTRB1 NPC1 32/4885RAB9A 2095/4885CYP3A4 1004/4885

“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.