SCHEMBL13071978

SCHEMBL13071978

Cc1ccc(C)c(-c2nc(C)c(C(=O)N3CCN(C4CCCC4)CC3)s2)c1Cl

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.47
HPGD P15428 1/20 0.47
HTR2C P28335 7/20 0.43
CNR1 P21554 1/20 0.43
LMNA P02545 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
KMT2A Q03164 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
L3MBTL3 Q96JM7 1/20 0.41
KDM4E B2RXH2 4/20 0.41
MEN1 O00255 1/20 0.40
RAB9A P51151 1/20 0.40
POLB P06746 1/20 0.40

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
SCHEMBL5549393 0.92 ALDH1A1 (0.44) ALDH1A1HPGDHTR2CCNR1LMNA
SCHEMBL3405777 0.88 HTR2C (0.50) ALDH1A1HPGDHTR2CCNR1LMNA
SCHEMBL3399406 0.84 ALDH1A1 (0.47) ALDH1A1HPGDHTR2CCNR1LMNA
SCHEMBL3398917 0.83 HRH3 (0.45) ALDH1A1HTR2CLMNAKMT2AL3MBTL1
SCHEMBL5549408 0.83 HRH3 (0.45) ALDH1A1HTR2CLMNAKMT2AL3MBTL1
SCHEMBL3398941 0.83 CNR1 (0.47) ALDH1A1HPGDHTR2CCNR1LMNA
SCHEMBL3398825 0.83 SCN5A (0.54) ALDH1A1HPGDCNR1LMNASMN1; SMN2
SCHEMBL3404822 0.82 THRA (0.50) ALDH1A1HPGDHTR2CCNR1LMNA
SCHEMBL3404938 0.82 HTR2C (0.48) ALDH1A1HPGDHTR2CCNR1LMNA
SCHEMBL3401632 0.82 HTR2C (0.46) ALDH1A1HPGDHTR2CCNR1LMNA

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-20100297035-A1 Thiazole Amides, Imidazole Amides and Related Analogues LIGAND PHARMACEUTICALS, INC. (US) 2010-11-25 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-20100297035-A1 Thiazole Amides, Imidazole Amides and Related Analogues HRH3, HRH4, HRH2 ALDH1A1 916/4885HPGD 1057/4885HTR2C 416/4885

“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.