SCHEMBL14587734

SCHEMBL14587734

CCN(CCN(C)C)C(=O)c1cc(NC(=O)c2cc(F)c(F)cc2Cl)[nH]n1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.40
HTT P42858 2/20 0.40
RECQL P46063 1/20 0.40
NPC1 O15118 4/20 0.39
RAB9A P51151 4/20 0.39
POLB P06746 1/20 0.38
APEX1 P27695 1/20 0.38
ALPL P05186 1/20 0.38
KMT2A Q03164 2/20 0.37
ALDH1A1 P00352 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
MAPT P10636 1/20 0.37
LMNA P02545 2/20 0.36
GAA P10253 1/20 0.36
MEN1 O00255 1/20 0.35
PTGES O14684 1/20 0.35
PYGL P06737 1/20 0.35
HPGD P15428 1/20 0.35
NTRK1 P04629 2/20 0.35

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 SCHEMBL5012305 0.99 CYP2C19 (0.40) CYP2C19HTTRECQLNPC1RAB9A
SCHEMBL5013595 0.92 HTT (0.43) CYP2C19HTTRECQLNPC1RAB9A
SCHEMBL5012277 0.91 HTT (0.46) CYP2C19HTTRECQLNPC1RAB9A
SCHEMBL5012141 0.90 HTT (0.43) CYP2C19HTTRECQLNPC1RAB9A
SCHEMBL5010390 0.86 HTT (0.47) CYP2C19HTTRECQLNPC1RAB9A
SCHEMBL5009816 0.84 HTT (0.43) CYP2C19HTTRECQLNPC1RAB9A
SCHEMBL5009786 0.84 USP2 (0.43) CYP2C19HTTRECQLNPC1RAB9A
SCHEMBL14587733 0.83 NTRK1 (0.47) CYP2C19HTTRECQLNPC1RAB9A
SCHEMBL14587649 0.83 HTT (0.44) CYP2C19HTTRECQLNPC1RAB9A
SCHEMBL5013507 0.82 SMN1; SMN2 (0.43) CYP2C19NPC1RAB9APOLBAPEX1

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
US-20070032529-A1 Pyrazole compounds and their use as antidiabetes agents JAPAN TOBACCO INC. (JP) 2007-02-08 US disclosed
US-20070032529-A1 Pyrazole compounds and their use as antidiabetes agents JAPAN TOBACCO INC. (JP) 2007-02-08 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-20070032529-A1 Pyrazole compounds and their use as antidiabetes agents PYGL, GYS2, AGL CYP2C19 517/4885HTT 4237/4885RECQL 766/4885

“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.