SCHEMBL7992244

SCHEMBL7992244

COC(=O)c1cc2ccc(-c3c(Sc4ccc(Cl)cn4)cnn3C3CCCCO3)cc2cn1

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FAAH O00519 12/20 0.37
RXRA P19793 1/20 0.37
RXRB P28702 1/20 0.37
RXRG P48443 1/20 0.37
CYP4F2 P78329 1/20 0.34
CYP4A11 Q02928 1/20 0.34
ABL1 P00519 2/20 0.34
ATR Q13535 1/20 0.34
IDH1 O75874 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
SCHEMBL1960914 0.91 RXRA (0.38) FAAHRXRARXRBRXRGCYP4F2
SCHEMBL8001350 0.82 RXRA (0.36) FAAHRXRARXRBRXRGIDH1
SCHEMBL12552411 0.81 P2RX3 (0.38) FAAHABL1
SCHEMBL1964129 0.79 RXRA (0.35) FAAHRXRARXRBRXRGCYP4F2
SCHEMBL12552327 0.77 FAAH (0.36) FAAHRXRARXRBRXRGCYP4F2
SCHEMBL15047195 0.77 RXRA (0.39) FAAHRXRARXRBRXRGCYP4F2
SCHEMBL8007810 0.74 CYP4F2 (0.38) FAAHRXRARXRBRXRGCYP4F2
SCHEMBL8004695 0.73 ABL1 (0.38) FAAHABL1
SCHEMBL8002482 0.72 SMN1; SMN2 (0.37) FAAH
SCHEMBL1964398 0.70 ALDH1A1 (0.38) FAAHABL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2299824-B1 PYRAZOLE DERIVATIVES USEFUL AS INHIBITORS OF FAAH MERCK SHARP & DOHME (US) 2013-06-19 EP disclosed
US-20110144056-A1 PYRAZOLE DERIVATIVES USEFUL AS INHIBITORS OF FAAH MERCK SHARP & DOHME CORP. 2011-06-16 US disclosed
US-20110144056-A1 PYRAZOLE DERIVATIVES USEFUL AS INHIBITORS OF FAAH MERCK SHARP & DOHME CORP. 2011-06-16 US disclosed
WO-2009151991-A1 PYRAZOLE DERIVATIVES USEFUL AS INHIBITORS OF FAAH MERCK & CO., INC. (US) 2009-12-17 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-20110144056-A1 PYRAZOLE DERIVATIVES USEFUL AS INHIBITORS OF FAAH FAAH, FAAH2, HRH2 FAAH 1/4885RXRA 3277/4885RXRB 3056/4885

“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.