SCHEMBL1012095

SCHEMBL1012095

CCOP(=O)(Cc1cccc(Oc2ncc(Br)cn2)c1)OCC

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CCNT1 O60563 6/20 0.39
CDK9 P50750 6/20 0.39
CETP P11597 1/20 0.35
EDNRB P24530 1/20 0.34
EDNRA P25101 1/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
HPGD P15428 2/20 0.34
HTT P42858 1/20 0.34
LMNA P02545 1/20 0.34
FFAR1 O14842 1/20 0.34
HDAC1 Q13547 1/20 0.34
USP2 O75604 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
TSHR P16473 1/20 0.33
CYP2C19 P33261 1/20 0.33

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
SCHEMBL30903845 0.89 CCNT1 (0.40) CCNT1CDK9CETPMEN1KMT2A
SCHEMBL27233590 0.87 KMT2A (0.46) CCNT1CDK9CETPMEN1KMT2A
SCHEMBL30903848 0.86 MAPK1 (0.41) CCNT1CDK9CETPMEN1KMT2A
SCHEMBL1011032 0.86 MAPK1 (0.41) CCNT1CDK9CETPMEN1KMT2A
SCHEMBL1011350 0.81 CYP3A4 (0.37) CYP3A4
SCHEMBL10867669 0.79 CETP (0.52) CETPHTTTSHR
SCHEMBL32691196 0.77 ALDH1A1 (0.43) CCNT1CDK9MEN1KMT2A
SCHEMBL1011533 0.77 MAPK1 (0.42) CCNT1CDK9CETPMEN1KMT2A
SCHEMBL27233661 0.77 CCNT1 (0.39) CCNT1CDK9CETPMEN1KMT2A
SCHEMBL1307260 0.77 IDO1 (0.43) CCNT1CDK9MEN1KMT2AHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8044052-B2 Inhibitors of fatty acid amide hydrolase; N-pyridin-3-yl-4-(3-{[5-(trifluoromethyl)pyridin-2-yl]oxy}benzylidene)piperidine-1-carboxamide; elevate brain anandamide levels; pain, urinary incontinence, cognitive disorders, anxiety, depression, sleeping, eating, movement disorders, glaucoma, psoriasis PFIZER INC. (US) 2011-10-25 US disclosed
EP-2076508-B1 BIARYL ETHER UREA COMPOUNDS PFIZER PROD INC (US) 2011-01-05 EP disclosed
EP-2076508-A2 BIARYL ETHER UREA COMPOUNDS Pfizer Products Inc. (US) 2009-07-08 EP disclosed
US-20080261941-A1 Biaryl Ether Urea Compounds Jazz Pharmaceuticals Therapeutics, Inc. 2008-10-23 US disclosed
WO-2008047229-A2 BIARYL ETHER UREA COMPOUNDS PFIZER PRODUCTS INC. (US) 2008-04-24 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-20080261941-A1 Biaryl Ether Urea Compounds FAAH, FAAH2, LIPC CCNT1 2821/4885CDK9 1591/4885CETP 120/4885

“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.