SCHEMBL3749845

SCHEMBL3749845

CCCC=Cc1ccc(-c2c(C)c(CNC(=S)NC3CCCCC3)nn2-c2ccc(Cl)cc2Cl)s1

nearest known ligand 0.58

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 11/20 0.58
CNR2 P34972 11/20 0.58
OPRL1 P41146 4/20 0.50
KCNH2 Q12809 2/20 0.49
MEN1 O00255 1/20 0.43
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
ALPL P05186 1/20 0.43
ALPI P09923 1/20 0.43
MAPT P10636 1/20 0.43
HPGD P15428 1/20 0.43
ALOX12 P18054 1/20 0.43
HTT P42858 1/20 0.43
KMT2A Q03164 1/20 0.43

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
SCHEMBL3749842 1.00 CNR1 (0.58) CNR1CNR2OPRL1KCNH2MEN1
SCHEMBL3746051 0.91 CNR1 (0.62) CNR1CNR2OPRL1KCNH2
SCHEMBL3746057 0.91 CNR1 (0.62) CNR1CNR2OPRL1KCNH2
SCHEMBL3747722 0.87 OPRL1 (0.56) CNR1CNR2OPRL1KCNH2MEN1
SCHEMBL3740079 0.87 CNR1 (0.64) CNR1CNR2OPRL1KCNH2
SCHEMBL3740069 0.87 CNR1 (0.64) CNR1CNR2OPRL1KCNH2
SCHEMBL3744169 0.87 CNR1 (0.64) CNR1CNR2OPRL1KCNH2
SCHEMBL3744163 0.87 CNR1 (0.64) CNR1CNR2OPRL1KCNH2
SCHEMBL3741225 0.86 CNR1 (0.63) CNR1CNR2OPRL1KCNH2
SCHEMBL3741230 0.86 CNR1 (0.63) CNR1CNR2OPRL1KCNH2

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-2068870-B1 THIOPHENE COMPOUNDS NAT HEALTH RESEARCH INSTITUTES (TW) 2013-03-27 EP disclosed
US-7834046-B2 Thiophene compounds NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2010-11-16 US disclosed
US-20090029969-A2 Thiophene Compounds NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2009-01-29 US disclosed
US-20080090810-A1 THIOPHENE COMPOUNDS NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2008-04-17 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 (2 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-20080090810-A1 THIOPHENE COMPOUNDS CNR1, CNR2, HTR2C CNR1 1/4885CNR2 2/4885OPRL1 4/4885
US-20090029969-A2 Thiophene Compounds CNR1, CNR2, HTR2C CNR1 1/4885CNR2 2/4885OPRL1 4/4885

“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.