SCHEMBL4492296

SCHEMBL4492296

OCCSc1ccc(C(F)(F)F)cn1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.56
L3MBTL1 Q9Y468 2/20 0.53
PKM P14618 1/20 0.53
KDM4E B2RXH2 1/20 0.51
RAB9A P51151 2/20 0.43
HSD17B3 P37058 1/20 0.43
RECQL P46063 1/20 0.42
ADORA1 P30542 2/20 0.41
KMT2A Q03164 1/20 0.41
MAPT P10636 1/20 0.40
DDB1 Q16531 1/20 0.39
CRBN Q96SW2 1/20 0.39
HRH3 Q9Y5N1 1/20 0.37
DAO P14920 1/20 0.35

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
SCHEMBL2585379 0.83 ALDH1A1 (0.56) ALDH1A1L3MBTL1PKMKDM4ERAB9A
SCHEMBL7797891 0.83 ALDH1A1 (0.56) ALDH1A1L3MBTL1PKMKDM4ERAB9A
SCHEMBL20381801 0.83 ALDH1A1 (0.57) ALDH1A1L3MBTL1PKMKDM4ERAB9A
SCHEMBL16592116 0.80 ALDH1A1 (0.54) ALDH1A1L3MBTL1PKMKDM4ERAB9A
SCHEMBL7023026 0.80 ALDH1A1 (0.50) ALDH1A1L3MBTL1PKMKDM4ERAB9A
SCHEMBL14234544 0.79 ALDH1A1 (0.56) ALDH1A1L3MBTL1PKMKDM4ERAB9A
SCHEMBL14350432 0.79 ALDH1A1 (0.52) ALDH1A1L3MBTL1PKMKDM4ERAB9A
SCHEMBL417669 0.79 ALDH1A1 (0.57) ALDH1A1L3MBTL1PKMKDM4ERAB9A
SCHEMBL14234396 0.78 ALDH1A1 (0.47) ALDH1A1L3MBTL1PKMKDM4ERAB9A
SCHEMBL4032772 0.77 ALDH1A1 (0.67) ALDH1A1L3MBTL1PKMKDM4ERAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7585883-B2 Substituted pyridines and their uses RIGEL PHARMACEUTICALS, INC. (US) 2009-09-08 US disclosed
EP-1817303-A2 SUBSTITUTED PYRIDINES WITH ACTIVITY ON SYK KINASE Rigel Pharmaceuticals, Inc. (US) 2007-08-15 EP disclosed
US-20060178407-A1 Substituted pyridines and their uses RIGEL PHARMACEUTICAL, INC. (US) 2006-08-10 US disclosed
WO-2006050480-A2 SUBSTITUTED PYRIDINES WITH ACTIVITY ON SYK KINASE RIGEL PHARMACEUTICALS, INC. (US) 2006-05-11 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-20060178407-A1 Substituted pyridines and their uses KIT, CPA3, CMA1 ALDH1A1 613/4885L3MBTL1 4496/4885PKM 2002/4885

“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.