SCHEMBL8002482

SCHEMBL8002482

CCn1cc(Sc2ccc(Cl)cn2)c(-c2ccc3cc(C(=O)OC)ncc3c2)n1

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.37
RAB9A P51151 2/20 0.37
NPC1 O15118 1/20 0.37
TSHR P16473 1/20 0.37
FAAH O00519 5/20 0.36
P2RX3 P56373 2/20 0.36
KMT2A Q03164 3/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
MEN1 O00255 2/20 0.34
LCK P06239 1/20 0.34
LMNA P02545 1/20 0.33
HTT P42858 1/20 0.33
GABRA2 P47869 2/20 0.33
GABRB2 P47870 2/20 0.33
MAPT P10636 1/20 0.33
NLRP3 Q96P20 1/20 0.32

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
SCHEMBL1963193 0.90 FAAH (0.47) SMN1; SMN2RAB9ANPC1TSHRFAAH
SCHEMBL12552411 0.82 P2RX3 (0.38) FAAHP2RX3KMT2AMEN1LCK
SCHEMBL8004695 0.78 ABL1 (0.38) FAAHKMT2AMEN1LCKLMNA
SCHEMBL8001623 0.74 FAAH (0.35) SMN1; SMN2RAB9ANPC1TSHRFAAH
SCHEMBL7992244 0.72 FAAH (0.37) FAAH
SCHEMBL1964398 0.71 ALDH1A1 (0.38) RAB9AFAAHP2RX3KMT2AMEN1
SCHEMBL8002500 0.71 FAAH (0.64) SMN1; SMN2RAB9ANPC1TSHRFAAH
SCHEMBL8004670 0.71 FAAH (0.54) SMN1; SMN2RAB9ANPC1TSHRFAAH
SCHEMBL7992245 0.70 ABL1 (0.34) SMN1; SMN2P2RX3LCKGABRA2MAPT
SCHEMBL740718 0.70 LCK (0.55) CYP1A2CYP2C19LCKLMNAGABRA2

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 SMN1; SMN2 696/4885RAB9A 2979/4885NPC1 1092/4885

“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.