SCHEMBL3467136

SCHEMBL3467136

Nc1nnc(Cc2ccc(C(F)(F)F)cc2)s1

nearest known ligand 0.63

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.63
LMNA P02545 4/20 0.58
HPGD P15428 3/20 0.58
POLB P06746 2/20 0.54
HTT P42858 1/20 0.54
LTA4H P09960 1/20 0.50
PKM P14618 1/20 0.49
HSD17B10 Q99714 1/20 0.49
MAPK1 P28482 1/20 0.48
IDO1 P14902 2/20 0.44
ATM Q13315 1/20 0.44
QPCT Q16769 2/20 0.43
QPCTL Q9NXS2 1/20 0.43
MBOAT4 Q96T53 1/20 0.42

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
SCHEMBL19793294 0.85 ATM (0.63) ALDH1A1LMNAHPGDPOLBHTT
SCHEMBL11749002 0.83 ALDH1A1 (0.53) ALDH1A1LMNAHPGDPOLBHTT
SCHEMBL3467590 0.81 LMNA (0.61) ALDH1A1LMNAHPGDPOLBHTT
SCHEMBL31409666 0.81 IDO1 (0.42) ALDH1A1LMNAHPGDPOLBHTT
SCHEMBL602492 0.81 ALDH1A1 (0.69) ALDH1A1LMNAHPGDPOLBHTT
SCHEMBL10284718 0.80 HSD11B1 (0.44) ALDH1A1LMNAHPGDLTA4HIDO1
SCHEMBL15884611 0.79 ALDH1A1 (0.70) ALDH1A1LMNAHPGDPOLBHTT
SCHEMBL11750879 0.78 ALDH1A1 (0.56) ALDH1A1LMNAHPGDPOLBHTT
SCHEMBL4220065 0.77 ALDH1A1 (0.69) ALDH1A1LMNAHPGDPOLBHTT
SCHEMBL3027076 0.77 ALDH1A1 (1.00) ALDH1A1LMNAHPGDPOLBHTT

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
WO-2025026997-A1 SUBSTITUED BICYCLIC HETEROCYCLIC YAP-TEAD AND/OR TAZ-TEAD INHIBITORS MERCK PATENT GMBH (DE) 2025-02-06 WO disclosed
WO-2010073011-A2 COMPOUNDS USEFUL AS MEDICAMENTS BETAGENON AB (SE) 2010-07-01 WO disclosed
US-20100120669-A1 THIADIAZOLE DERIVATIVES, INHIBITORS OF STEAROYL-COA DESATURASE BOUILLOT ANNE MARIE JEANNE 2010-05-13 US disclosed
US-4054665-A 2-Amino-5-(trifluoromethylphenylalkyl)-1,3,4 thiadiazoles used in the treatment of insomnia and anxiety SANDOZ, INC. (US) 1977-10-18 US disclosed
US-3965110-A 2-Amino-5-(trifluoromethyl phenylalkyl)-1,3,4-thiadiazoles SANDOZ, INC. (US) 1976-06-22 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-20100120669-A1 THIADIAZOLE DERIVATIVES, INHIBITORS OF STEAROYL-COA DESATURASE SCD, SCD5, FADS2 ALDH1A1 458/4885LMNA 2761/4885HPGD 203/4885

“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.