SCHEMBL1963193

SCHEMBL1963193

CCn1cc(Sc2ccc(Cl)cc2)c(-c2ccc3cc(C(=O)OC)ncc3c2)n1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 4/20 0.47
MAPK1 P28482 1/20 0.38
KMT2A Q03164 2/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
MAPT P10636 2/20 0.37
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
HPGD P15428 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
RAB9A P51151 2/20 0.36
NPC1 O15118 1/20 0.36
TSHR P16473 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
P2RX3 P56373 2/20 0.36
MEN1 O00255 1/20 0.36

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
SCHEMBL8002482 0.90 SMN1; SMN2 (0.37) FAAHKMT2ACYP1A2CYP2D6CYP2C9
SCHEMBL1964398 0.81 ALDH1A1 (0.38) FAAHMAPK1KMT2AMAPTKDM4E
SCHEMBL1961529 0.77 FAAH (0.48) FAAHMAPK1KMT2AMAPTKDM4E
SCHEMBL1961838 0.75 KDM4E (0.47) FAAHMAPK1KMT2ACYP1A2CYP2D6
SCHEMBL740718 0.71 LCK (0.55) MAPK1CYP1A2CYP2C19MAPTKDM4E
SCHEMBL12552411 0.71 P2RX3 (0.38) FAAHKMT2AP2RX3MEN1LCK
SCHEMBL1535270 0.69 FAAH (0.64) FAAHKCNH2
SCHEMBL8001348 0.69 FAAH (0.39) FAAHMAPTALDH1A1LMNAHPGD
SCHEMBL1001659 0.68 FAAH (0.48) FAAHALDH1A1LMNASMN1; SMN2P2RX3
SCHEMBL12552319 0.68 FAAH (0.56) FAAHKMT2AMAPTMEN1KCNH2

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 2 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

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 1/4885MAPK1 2594/4885KMT2A 1541/4885

“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.