SCHEMBL12249115

SCHEMBL12249115

Cc1cccc(Oc2cc(C)c(-c3csc(NC(=O)c4ccncc4)n3)c(C)c2)c1

nearest known ligand 0.60

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GCK P35557 7/20 0.60
MAPT P10636 2/20 0.56
ALDH1A1 P00352 1/20 0.56
THRB P10828 1/20 0.56
PARP1 P09874 1/20 0.53
ADORA3 P0DMS8 2/20 0.49
LMNA P02545 1/20 0.47
TSHR P16473 1/20 0.47
MAPK1 P28482 1/20 0.47
STAT3 P40763 1/20 0.47
HSD17B10 Q99714 1/20 0.47
KDM4A O75164 1/20 0.47
KDM4B O94953 1/20 0.47
KDM5C P41229 1/20 0.47
KDM5B Q9UGL1 1/20 0.47
GRM5 P41594 1/20 0.47
ROCK2 O75116 1/20 0.47
ROCK1 Q13464 1/20 0.47

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
SCHEMBL12249111 0.92 MAPT (0.58) GCKMAPTALDH1A1THRBPARP1
SCHEMBL12300952 0.91 MAPT (0.66) GCKMAPTALDH1A1THRBPARP1
SCHEMBL12249080 0.91 PARP1 (0.61) GCKMAPTALDH1A1THRBPARP1
SCHEMBL14992571 0.90 PARP1 (0.60) GCKMAPTALDH1A1THRBPARP1
SCHEMBL12248436 0.89 GCK (0.54) GCKMAPTALDH1A1THRBPARP1
SCHEMBL15004206 0.86 MAPT (0.51) GCKMAPTALDH1A1THRBPARP1
SCHEMBL14992546 0.86 MAPT (0.55) MAPTALDH1A1THRBPARP1ADORA3
SCHEMBL12300930 0.86 MAPT (0.58) MAPTALDH1A1THRBPARP1ADORA3
SCHEMBL16523127 0.85 MAPT (0.52) GCKMAPTALDH1A1THRBPARP1
SCHEMBL12249093 0.85 GCK (0.56) GCKMAPTALDH1A1THRBPARP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9409902-B2 Modulators of HEC1 activity and methods therefor TAIVEX THERAPEUTICS CORPORATION (TW) 2016-08-09 US disclosed
US-20150250794-A1 MODULATORS OF HEC1 ACTIVITY AND METHODS THEREFOR TAIVEX THERAPEUTICS CORP (TW) 2015-09-10 US disclosed
US-8999983-B2 Modulators of Hec1 activity and methods therefor TAIVEX THERAPEUTICS CORPORATION (TW) 2015-04-07 US disclosed
US-20150057281-A1 MODULATORS OF HEC1 ACTIVITY AND METHODS THEREFOR TAIVEX THERAPEUTICS CORPORATION (TW) 2015-02-26 US disclosed
US-8946268-B2 Modulators of HEC1 activity and methods therefor TAIVEX THERAPEUTICS, INC. (TW) 2015-02-03 US disclosed
US-20130190312-A1 MODULATORS OF HEC1 ACTIVITY AND METHODS THEREFOR TAIVEX THERAPEUTICS CORPORATION (TW) 2013-07-25 US disclosed
US-20110230486-A1 Modulators Of HEC1 Activity And Methods Therefor TAIVEX THERAPEUTICS CORPORATION (TW) 2011-09-22 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 (4 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-20130190312-A1 MODULATORS OF HEC1 ACTIVITY AND METHODS THEREFOR WEE1, WEE2, NEK11 GCK 2453/4885MAPT 2904/4885ALDH1A1 3121/4885
US-20150250794-A1 MODULATORS OF HEC1 ACTIVITY AND METHODS THEREFOR WEE1, WEE2, NEK11 GCK 2453/4885MAPT 2904/4885ALDH1A1 3121/4885
US-20150057281-A1 MODULATORS OF HEC1 ACTIVITY AND METHODS THEREFOR WEE1, WEE2, NEK11 GCK 2645/4885MAPT 2820/4885ALDH1A1 3229/4885
US-20110230486-A1 Modulators Of HEC1 Activity And Methods Therefor WEE1, WEE2, NEK11 GCK 2645/4885MAPT 2820/4885ALDH1A1 3229/4885

“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.