SCHEMBL16169593

SCHEMBL16169593

Cc1c(C)c(C)c2c(cc(C)n2C)c1C

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CASP1 P29466 1/20 0.32
CASP7 P55210 1/20 0.32
HSD17B10 Q99714 1/20 0.32
DHFR P00374 1/20 0.30

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
SCHEMBL22434671 0.75
SCHEMBL22434751 0.72 ALKBH5 (0.42) CASP1CASP7HSD17B10DHFR
SCHEMBL22434867 0.71
SCHEMBL12789752 0.70 KDM4E (0.46)
SCHEMBL22434746 0.67 KDM4E (0.34) CASP1CASP7HSD17B10DHFR
SCHEMBL22434670 0.67 PKM (0.30)
SCHEMBL22434755 0.67 CASP1 (0.33) CASP1CASP7HSD17B10DHFR
SCHEMBL22434672 0.66
SCHEMBL22434864 0.66 PARP15 (0.33) CASP1CASP7HSD17B10
SCHEMBL22434862 0.66

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-20180040834-A1 ORGANIC LIGHT EMITTING COMPOUND AND ORGANIC LIGHT EMITTING DIODE INCLUDING THE SAME SFC CO., LTD. (KR) 2018-02-08 US disclosed
US-20170207397-A1 ORGANIC LIGHT EMITTING COMPOUNDS AND ORGANIC LIGHT EMITTING DEVICES INCLUDING THE SAME SFC CO., LTD. (KR) 2017-07-20 US disclosed
US-9676715-B2 Bis-indolic derivatives, a process for preparing the same and their uses as a drug UNIVERSITE JOSEPH FOURIER (FR) 2017-06-13 US disclosed
US-20140309272-A1 BIS-INDOLIC DERIVATIVES, A PROCESS FOR PREPARING THE SAME AND THEIR USES AS A DRUG UNIVERSITE JOSEPH FOURIER (FR) 2014-10-16 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 (3 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-20180040834-A1 ORGANIC LIGHT EMITTING COMPOUND AND ORGANIC LIGHT EMITTING DIODE INCLUDING THE SAME HARS1, ALDH1A2, ALDH1A1 CASP1 1435/4885CASP7 3903/4885HSD17B10 84/4885
US-20170207397-A1 ORGANIC LIGHT EMITTING COMPOUNDS AND ORGANIC LIGHT EMITTING DEVICES INCLUDING THE SAME HARS1, ALDH1A2, ALDH1A3 CASP1 1494/4885CASP7 3492/4885HSD17B10 94/4885
US-20140309272-A1 BIS-INDOLIC DERIVATIVES, A PROCESS FOR PREPARING THE SAME AND THEIR USES AS A DRUG IDO1, ITPA, IDO2 CASP1 1050/4885CASP7 1313/4885HSD17B10 2537/4885

“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.