SCHEMBL6035562

SCHEMBL6035562

Cc1nn(-c2ccc(C(F)(F)F)cn2)cc1/C=C/C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.41
CYP1A2 P05177 2/20 0.41
CYP2C9 P11712 2/20 0.41
CYP2C19 P33261 2/20 0.41
SMN1; SMN2 Q16637 6/20 0.41
MAPT P10636 7/20 0.40
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.40
HDAC4 P56524 1/20 0.40
KDM4E B2RXH2 7/20 0.39
ALDH1A1 P00352 2/20 0.39
APAF1 O14727 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
POLB P06746 1/20 0.38
PPARG P37231 1/20 0.38
PPARD Q03181 1/20 0.38
PPARA Q07869 1/20 0.38

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
SCHEMBL6035566 1.00 HPGD (0.41) HPGDCYP1A2CYP2C9CYP2C19SMN1; SMN2
SCHEMBL6035593 0.86 HPGD (0.40) HPGDCYP1A2CYP2C9CYP2C19SMN1; SMN2
SCHEMBL6035587 0.86 HPGD (0.40) HPGDCYP1A2CYP2C9CYP2C19SMN1; SMN2
SCHEMBL6034476 0.85 HDAC4 (0.40) HPGDCYP1A2CYP2C9CYP2C19SMN1; SMN2
SCHEMBL6034471 0.85 HDAC4 (0.40) HPGDCYP1A2CYP2C9CYP2C19SMN1; SMN2
SCHEMBL6035842 0.84 SMN1; SMN2 (0.40) HPGDCYP1A2CYP2C9CYP2C19SMN1; SMN2
SCHEMBL6034585 0.84 SMN1; SMN2 (0.40) HPGDCYP1A2CYP2C9CYP2C19SMN1; SMN2
SCHEMBL6035837 0.84 SMN1; SMN2 (0.40) HPGDCYP1A2CYP2C9CYP2C19SMN1; SMN2
SCHEMBL6034584 0.84 SMN1; SMN2 (0.40) HPGDCYP1A2CYP2C9CYP2C19SMN1; SMN2
SCHEMBL716206 0.83 KDM4E (0.44) HPGDCYP1A2CYP2C9CYP2C19SMN1; SMN2

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060148858-A1 1, 2-Azole derivatives with hypoglycemic and hypolipidemic activity TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-07-06 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-20060148858-A1 1, 2-Azole derivatives with hypoglycemic and hypolipidemic activity GPR119, SLC5A1, CYP4B1 HPGD 3297/4885CYP1A2 95/4885CYP2C9 161/4885

“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.