SCHEMBL5099223

SCHEMBL5099223

Cc1ccc(-c2cc(C)ccc2NC(=O)OC(=O)C(F)(F)F)cc1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.43
CHRM3 P20309 12/20 0.41
CYP1A2 P05177 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
METAP2 P50579 1/20 0.39
ALDH1A1 P00352 2/20 0.38
NPC1 O15118 1/20 0.37
POLB P06746 1/20 0.37
MAPT P10636 1/20 0.37
RAB9A P51151 1/20 0.37
AKR1C3 P42330 1/20 0.36
AKR1C2 P52895 1/20 0.36
CHRM2 P08172 1/20 0.36
CHRM1 P11229 1/20 0.36

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
SCHEMBL5106700 0.93 CHRM3 (0.43) HPGDCHRM3CHRM2CHRM1
SCHEMBL5106998 0.92 CHRM3 (0.45) CHRM3CHRM2CHRM1
SCHEMBL5103245 0.89 HPGD (0.43) HPGDCYP1A2CYP2C9CYP2C19SMN1; SMN2
SCHEMBL5103798 0.88 CHRM3 (0.44) HPGDCHRM3
SCHEMBL5103241 0.87 CHRM3 (0.38) HPGDCHRM3CYP1A2CYP2C9CYP2C19
SCHEMBL5099118 0.85 CHRM3 (0.49) CHRM3CHRM2CHRM1
SCHEMBL5113733 0.85 CHRM3 (0.54) CHRM3CHRM2CHRM1
SCHEMBL5103759 0.84 CHRM3 (0.41) HPGDCHRM3SMN1; SMN2NPC1AKR1C3
SCHEMBL5106874 0.84 CHRM3 (0.46) CHRM3CHRM2CHRM1
SCHEMBL5113237 0.83 FABP4 (0.41) CYP1A2CYP2C9CYP2C19SMN1; SMN2NPC1

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-20080249127-A1 Muscarinic Acetylcholine Receptor Antagonists LAINE DRAMANE I 2008-10-09 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-20080249127-A1 Muscarinic Acetylcholine Receptor Antagonists CHRM3, CHRNG, CHRM2 HPGD 1575/4885CHRM3 1/4885CYP1A2 2423/4885

“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.