SCHEMBL14587716

SCHEMBL14587716

CN1CCN(C(=O)c2cc(NC(=O)c3cc(F)c(F)cc3Cl)[nH]n2)CC1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.47
NTRK1 P04629 2/20 0.47
HPGD P15428 2/20 0.44
TSHR P16473 2/20 0.43
MAPT P10636 1/20 0.43
ENPP2 Q13822 2/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
LMNA P02545 2/20 0.40
HTT P42858 1/20 0.40
HSP90AA1 P07900 1/20 0.40
TP53 P04637 1/20 0.40
ALOX15 P16050 1/20 0.40
ALPL P05186 1/20 0.40
POLB P06746 1/20 0.40
APEX1 P27695 1/20 0.40
HRH4 Q9H3N8 1/20 0.39

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
SCHEMBL14587714 0.89 HPGD (0.59) SMN1; SMN2HPGDTSHRMAPTNPC1
SCHEMBL14587717 0.84 SMN1; SMN2 (0.46) SMN1; SMN2NTRK1HPGDTSHRMAPT
SCHEMBL14587718 0.82 GAA (0.51) SMN1; SMN2HPGDMEN1KMT2ANPC1
SCHEMBL14587715 0.81 TSHR (0.48) SMN1; SMN2HPGDTSHRMAPTMEN1
SCHEMBL5009795 0.80 HTR1F (0.40) SMN1; SMN2NTRK1HPGDENPP2KMT2A
SCHEMBL3822963 0.79 PYGL (0.50) SMN1; SMN2HPGDMAPTMEN1KMT2A
SCHEMBL13933418 0.78 GRM5 (0.41) SMN1; SMN2NPC1RAB9ALMNA
SCHEMBL5010442 0.78 NPC1 (0.49) SMN1; SMN2HPGDMAPTMEN1KMT2A
SCHEMBL14587721 0.76 AVPR2 (0.49) SMN1; SMN2RAB9A
SCHEMBL3820591 0.76 NPC1 (0.40) SMN1; SMN2HPGDMAPTMEN1KMT2A

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 SMN1; SMN2 4705/4885NTRK1 4549/4885HPGD 3765/4885

“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.