SCHEMBL18138561

SCHEMBL18138561

O=C1Nc2c(c(C3CCN(c4ncc(C(F)(F)F)cc4Cl)CC3)nn2C(c2ccccc2)c2ccccc2)[C@@H](C(F)(F)F)[C@H]1O

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ LCAT P04180 7/20 0.59
▸ MAPT P10636 3/20 0.46
▸ CYP2C9 P11712 3/20 0.46
▸ CYP2C19 P33261 3/20 0.46
▸ GAA P10253 1/20 0.46
▸ MEN1 O00255 2/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ CHRM4 P08173 3/20 0.42
▸ LMNA P02545 2/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ KDM4E B2RXH2 3/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ PKM P14618 1/20 0.41

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
SCHEMBL18138563 1.00 LCAT (0.59) LCATMAPTCYP2C9CYP2C19GAA
SCHEMBL18138565 1.00 LCAT (0.59) LCATMAPTCYP2C9CYP2C19GAA
SCHEMBL19485089 0.91 LCAT (0.50) LCATMAPTCYP2C9CYP2C19GAA
SCHEMBL18138496 0.86 LCAT (0.59) LCAT
SCHEMBL18138494 0.86 LCAT (0.59) LCAT
SCHEMBL18138503 0.86 LCAT (0.59) LCAT
SCHEMBL18138507 0.86 LCAT (0.59) LCAT
SCHEMBL18138495 0.86 LCAT (0.59) LCAT
SCHEMBL18138629 0.84 LCAT (0.59) LCAT
SCHEMBL18138630 0.84 LCAT (0.59) LCAT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3081566-B1 5-HYDROXY-4-(TRIFLUOROMETHYL)PYRAZOLOPYRIDINE DERIVATIVE DAIICHI SANKYO CO LTD (JP) 2018-03-07 — — EP disclosed
US-9796709-B2 5-hydroxy-4-(trifluoromethyl)pyrazolopyridine derivative DAIICHI SANKYO COMPANY, LIMITED (JP) 2017-10-24 — — US disclosed
US-9796709-B2 5-hydroxy-4-(trifluoromethyl)pyrazolopyridine derivative DAIICHI SANKYO COMPANY, LIMITED (JP) 2017-10-24 — — US disclosed
US-20160376267-A1 5-HYDROXY-4-(TRIFLUOROMETHYL)PYRAZOLOPYRIDINE DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 2016-12-29 — — US disclosed
EP-3081566-A1 5-HYDROXY-4-(TRIFLUOROMETHYL)PYRAZOLOPYRIDINE DERIVATIVE Daiichi Sankyo Company, Limited (JP) 2016-10-19 — — EP 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-20160376267-A1 5-HYDROXY-4-(TRIFLUOROMETHYL)PYRAZOLOPYRIDINE DERIVATIVE LDLR, LCAT, LPL LCAT 2/4885MAPT 984/4885CYP2C9 3459/4885

“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.

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