SCHEMBL20249799

SCHEMBL20249799

O=C(Cc1ccccc1F)Nc1ccn(-c2cc(F)ccc2F)n1

nearest known ligand 0.69

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ELOVL1 Q9BW60 6/20 0.69
▸ ALDH1A1 P00352 3/20 0.45
▸ KMT2A Q03164 4/20 0.44
▸ RAB9A P51151 4/20 0.43
▸ MEN1 O00255 2/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ LMNA P02545 2/20 0.42
▸ MAPT P10636 1/20 0.42
▸ CACNA1G O43497 2/20 0.42
▸ CACNA1H O95180 2/20 0.42
▸ CACNA1I Q9P0X4 2/20 0.42
▸ NPC1 O15118 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
SCHEMBL20250017 0.89 ELOVL1 (0.77) ELOVL1ALDH1A1KMT2ARAB9ALMNA
SCHEMBL20249947 0.87 ELOVL1 (0.64) ELOVL1ALDH1A1RAB9ASMN1; SMN2MAPT
SCHEMBL20250016 0.85 ELOVL1 (0.86) ELOVL1ALDH1A1KMT2ARAB9AMEN1
SCHEMBL20249741 0.84 ELOVL1 (0.80) ELOVL1MAPTCACNA1GCACNA1HCACNA1I
SCHEMBL20485390 0.83 ELOVL1 (0.78) ELOVL1ALDH1A1SMN1; SMN2LMNAMAPT
SCHEMBL20250176 0.83 ELOVL1 (0.78) ELOVL1ALDH1A1KMT2ARAB9AMEN1
SCHEMBL20242031 0.82 ELOVL1 (1.00) ELOVL1ALDH1A1SMN1; SMN2LMNAMAPT
SCHEMBL20249761 0.81 ELOVL1 (0.79) ELOVL1ALDH1A1KMT2ALMNAMAPT
SCHEMBL20250077 0.81 ELOVL1 (0.68) ELOVL1ALDH1A1KMT2ARAB9ALMNA
SCHEMBL20249783 0.81 ELOVL1 (0.82) ELOVL1ALDH1A1KMT2ALMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180251431-A1 1,3-SUBSTITUTED PYRAZOLE COMPOUNDS USEFUL FOR REDUCTION OF VERY LONG CHAIN FATTY ACID LEVELS VERTEX PHARMACEUTICALS INCORPORATED 2018-09-06 — — US claimed
US-20180251431-A1 1,3-SUBSTITUTED PYRAZOLE COMPOUNDS USEFUL FOR REDUCTION OF VERY LONG CHAIN FATTY ACID LEVELS VERTEX PHARMACEUTICALS INCORPORATED 2018-09-06 — — US disclosed
WO-2018107056-A1 1,3-SUBSTITUED PYRAZOLE COMPOUNDS USEFUL FOR REDUCTION OF VERY LONG CHAIN FATTY ACIC LEVELS VERTEX PHARMACEUTICALS INCORPORATED (US) 2018-06-14 — — WO 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-20180251431-A1 1,3-SUBSTITUTED PYRAZOLE COMPOUNDS USEFUL FOR REDUCTION OF VERY LONG CHAIN FATTY ACID LEVELS HSD17B4, CPT1A, ADH1A ELOVL1 39/4885ALDH1A1 69/4885KMT2A 2360/4885

“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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