SCHEMBL26552253

SCHEMBL26552253

C/C(C#N)=C/c1ccc(F)c(F)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TRPA1 O75762 1/20 0.47
▸ GABRA1 P14867 3/20 0.45
▸ GABRG2 P18507 2/20 0.45
▸ GABRB3 P28472 2/20 0.45
▸ LMNA P02545 3/20 0.44
▸ NFE2L2 Q16236 2/20 0.43
▸ ALDH1A1 P00352 4/20 0.38
▸ KDM4E B2RXH2 3/20 0.38
▸ MEN1 O00255 3/20 0.38
▸ MAPT P10636 3/20 0.38
▸ KMT2A Q03164 3/20 0.38
▸ CYP1A2 P05177 3/20 0.38
▸ EGFR P00533 3/20 0.38
▸ TP53 P04637 2/20 0.38
▸ HPGD P15428 2/20 0.38
▸ HSD17B10 Q99714 2/20 0.38
▸ ALPL P05186 1/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ CYP2D6 P10635 1/20 0.38
▸ CYP19A1 P11511 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
SCHEMBL26552250 0.86 GABRA1 (0.41) TRPA1GABRA1GABRG2GABRB3LMNA
SCHEMBL26552260 0.82 GABRA1 (0.40) TRPA1GABRA1GABRG2GABRB3LMNA
SCHEMBL4656320 0.81 ALDH1A1 (0.61) TRPA1LMNAALDH1A1KDM4EMEN1
SCHEMBL13710832 0.80 ALDH1A1 (0.56) GABRA1GABRG2GABRB3LMNAALDH1A1
SCHEMBL26552234 0.79 ALDH1A1 (0.53) TRPA1GABRA1GABRG2GABRB3LMNA
SCHEMBL26552233 0.76 MAPT (0.54) LMNANFE2L2MAPTCYP1A2CYP3A4
SCHEMBL11761824 0.75 GABRA1 (0.58) TRPA1GABRA1GABRG2GABRB3LMNA
SCHEMBL11761830 0.75 GABRA1 (0.58) TRPA1GABRA1GABRG2GABRB3LMNA
SCHEMBL13969038 0.74 ALDH1A1 (0.50) GABRA1GABRG2GABRB3LMNAALDH1A1
SCHEMBL13710861 0.74 ALDH1A1 (0.50) GABRA1GABRG2GABRB3LMNAALDH1A1

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-20240025895-A1 COMPOSITIONS AND METHODS FOR MODULATING HAIR GROWTH THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2024-01-25 — — US disclosed
US-11787804-B2 Compositions and methods for modulating hair growth THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2023-10-17 — — 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 (2 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-11787804-B2 Compositions and methods for modulating hair growth PC, FH, SLC25A1 TRPA1 2663/4885GABRA1 3526/4885GABRG2 2689/4885
US-20240025895-A1 COMPOSITIONS AND METHODS FOR MODULATING HAIR GROWTH PC, FH, SLC25A1 TRPA1 2663/4885GABRA1 3526/4885GABRG2 2689/4885

“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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