SCHEMBL14601237

SCHEMBL14601237

COc1ccc(C(=O)N(CC2=NCCN2)C/C(C)=C/c2ccc(F)cc2F)cc1OC

nearest known ligand 0.58

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ACKR3 P25106 16/20 0.58
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C19 P33261 1/20 0.38
WDR5 P61964 1/20 0.37
ELANE P08246 1/20 0.37

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
Hydrochloric Acid SCHEMBL4755354 0.99 ACKR3 (0.58) ACKR3CYP1A2CYP3A4CYP2C19WDR5
Hydrochloric Acid SCHEMBL4755349 0.99 ACKR3 (0.58) ACKR3CYP1A2CYP3A4CYP2C19WDR5
SCHEMBL14601244 0.79 ACKR3 (0.64) ACKR3
SCHEMBL14601246 0.79 ACKR3 (0.64) ACKR3
Hydrochloric Acid SCHEMBL4700900 0.78 ACKR3 (0.63) ACKR3
Hydrochloric Acid SCHEMBL4700902 0.78 ACKR3 (0.63) ACKR3
Hydrochloric Acid SCHEMBL4788794 0.78 ACKR3 (0.63) ACKR3
SCHEMBL4754403 0.75 ACKR3 (0.54) ACKR3
SCHEMBL4754398 0.75 ACKR3 (0.54) ACKR3
SCHEMBL3543699 0.75 ACKR3 (0.57) ACKR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070021484-A1 Substituted N-cinnamyl benzamides CHEMOCENTRYX, INC. (US) 2007-01-25 US disclosed
US-20070021484-A1 Substituted N-cinnamyl benzamides CHEMOCENTRYX, INC. (US) 2007-01-25 US disclosed
WO-2007002842-A2 SUBSTITUTED N-CINNAMYL BENZAMIDES CHEMOCENTRYX, INC. (US) 2007-01-04 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-20070021484-A1 Substituted N-cinnamyl benzamides BRDT, BCCIP, NAT10 ACKR3 4393/4885CYP1A2 1524/4885CYP3A4 896/4885

“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.