SCHEMBL2978432

SCHEMBL2978432

Cc1ccc(C(=O)c2c(C)n(-c3ccc(CO)cc3)c3ccccc23)cc1

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RORC P51449 1/20 0.56
MAPT P10636 3/20 0.48
LMNA P02545 1/20 0.48
HTT P42858 1/20 0.48
USP14 P54578 7/20 0.47
HDAC6 Q9UBN7 2/20 0.47
POLB P06746 1/20 0.46
TP53 P04637 2/20 0.44
KDM4E B2RXH2 1/20 0.44
GAA P10253 1/20 0.44
CNR2 P34972 1/20 0.43

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
SCHEMBL2983398 0.90 RORC (0.54) RORCMAPTLMNAHTTUSP14
SCHEMBL2984681 0.84 RORC (0.51) RORCMAPTLMNAHTTUSP14
SCHEMBL2980941 0.84 SMN1; SMN2 (0.54) RORCMAPTLMNAHTTTP53
SCHEMBL2978547 0.82 RORC (0.49) RORCMAPTLMNAHTTUSP14
SCHEMBL2982062 0.82 RORC (0.49) RORCMAPTLMNAHTTUSP14
SCHEMBL2984839 0.80 RORC (0.47) RORCMAPTLMNAHTTUSP14
SCHEMBL14409138 0.80 RORC (0.58) RORCUSP14HDAC6CNR2
SCHEMBL2980990 0.79 RORC (0.46) RORCMAPTLMNAHTTUSP14
SCHEMBL2980581 0.78 RORC (0.45) RORCMAPTLMNAHTTUSP14
SCHEMBL2980992 0.78 RORC (0.43) RORCMAPTUSP14HDAC6POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100286144-A1 HETEROARYL DERIVATIVES TAKAHASHI YOKO 2010-11-11 US disclosed
US-20100286144-A1 HETEROARYL DERIVATIVES TAKAHASHI YOKO 2010-11-11 US disclosed
US-20100286144-A1 HETEROARYL DERIVATIVES TAKAHASHI YOKO 2010-11-11 US disclosed
US-7781479-B2 Heteroaryl derivatives DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2010-08-24 US disclosed
US-7781479-B2 Heteroaryl derivatives DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2010-08-24 US disclosed
US-7781479-B2 Heteroaryl derivatives DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2010-08-24 US disclosed
US-20080167306-A1 Novel Heteroaryl Derivative DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2008-07-10 US disclosed
US-20080167306-A1 Novel Heteroaryl Derivative DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2008-07-10 US disclosed
US-20080167306-A1 Novel Heteroaryl Derivative DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2008-07-10 US disclosed
EP-1837329-A1 NOVEL HETEROARYL DERIVATIVE Dainippon Sumitomo Pharma Co., Ltd. (JP) 2007-09-26 EP disclosed
EP-1837329-A1 NOVEL HETEROARYL DERIVATIVE Dainippon Sumitomo Pharma Co., Ltd. (JP) 2007-09-26 EP 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-20100286144-A1 HETEROARYL DERIVATIVES GPR119, SLC2A1, SLC2A4 RORC 1515/4885MAPT 4724/4885LMNA 1680/4885
US-20080167306-A1 Novel Heteroaryl Derivative GPR119, SLC2A4, SLC5A2 RORC 1977/4885MAPT 4727/4885LMNA 1803/4885

“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.