SCHEMBL120632

SCHEMBL120632

N#Cc1cc2sccc2s1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GPR35 Q9HC97 1/20 0.42
HDAC3 O15379 1/20 0.40
HDAC4 P56524 1/20 0.40
HDAC1 Q13547 1/20 0.40
HDAC7 Q8WUI4 1/20 0.40
HDAC2 Q92769 1/20 0.40
HDAC10 Q969S8 1/20 0.40
HDAC11 Q96DB2 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
HDAC9 Q9UKV0 1/20 0.40
HDAC5 Q9UQL6 1/20 0.40
GAA P10253 3/20 0.38
ALDH1A1 P00352 1/20 0.38
POLB P06746 1/20 0.35
GLA P06280 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
PNMT P11086 1/20 0.31

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
SCHEMBL13451229 0.78 GPR35 (0.42) GPR35HDAC3HDAC4HDAC1HDAC7
SCHEMBL19439609 0.78 PNMT (0.38) PNMT
SCHEMBL12278790 0.74 CYP2A6 (0.33) GAAALDH1A1
SCHEMBL147153 0.70
SCHEMBL14711199 0.69 GPR35 (0.39) GPR35HDAC3HDAC4HDAC1HDAC7
SCHEMBL845679 0.69 GPR35 (0.50) GPR35HDAC3HDAC4HDAC1HDAC7
SCHEMBL18386510 0.68 ALDH1A1 (0.34) ALDH1A1PNMT
SCHEMBL18876220 0.68 HDAC3 (0.42) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL12320834 0.68 PTPN2 (0.33)
SCHEMBL5951124 0.68 CYP2A6 (0.42)

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 28 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11193065-B2 Liquid crystal composition, method of producing the same, and retardation film constituted from the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2021-12-07 US disclosed
US-20200165519-A1 POLYMERIZABLE LIQUID CRYSTAL COMPOSITION AND RETARDATION PLATE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2020-05-28 US disclosed
US-20190276744-A1 LIQUID CRYSTAL COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2019-09-12 US disclosed
US-10407619-B2 Liquid crystal composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2019-09-10 US disclosed
US-10336938-B2 Liquid crystal composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2019-07-02 US disclosed
US-10177313-B2 Diketopyrrolopyrrole polymers for use in organic semiconductor devices BASF SE (DE) 2019-01-08 US disclosed
US-20170335191-A1 LIQUID CRYSTAL COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-11-23 US disclosed
US-20170335191-A1 LIQUID CRYSTAL COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-11-23 US disclosed
US-20170306234-A1 LIQUID CRYSTAL COMPOSITION, METHOD OF PRODUCING THE SAME, AND RETARDATION FILM CONSTITUTED FROM THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-10-26 US disclosed
US-20170306234-A1 LIQUID CRYSTAL COMPOSITION, METHOD OF PRODUCING THE SAME, AND RETARDATION FILM CONSTITUTED FROM THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-10-26 US disclosed
EP-2411986-B1 DIKETOPYRROLOPYRROLE POLYMERS FOR USE IN ORGANIC SEMICONDUCTOR DEVICES BASF SE (DE) 2016-09-21 EP disclosed
US-20140303335-A1 DIKETOPYRROLOPYRROLE POLYMERS FOR USE IN ORGANIC SEMICONDUCTOR DEVICES BASF SE (DE) 2014-10-09 US disclosed
US-20140303335-A1 DIKETOPYRROLOPYRROLE POLYMERS FOR USE IN ORGANIC SEMICONDUCTOR DEVICES BASF SE (DE) 2014-10-09 US disclosed
US-8796469-B2 Diketopyrrolopyrrole polymers for use in organic semiconductor devices BASF SE (DE) 2014-08-05 US disclosed
US-8796469-B2 Diketopyrrolopyrrole polymers for use in organic semiconductor devices BASF SE (DE) 2014-08-05 US disclosed
US-20120059140-A1 DIKETOPYRROLOPYRROLE POLYMERS FOR USE IN ORGANIC SEMICONDUCTOR DEVICES BASF SE (DE) 2012-03-08 US disclosed
US-20120059140-A1 DIKETOPYRROLOPYRROLE POLYMERS FOR USE IN ORGANIC SEMICONDUCTOR DEVICES BASF SE (DE) 2012-03-08 US disclosed
US-20110317628-A1 METHOD OF PERFORMING WIRELESS COMMUNICATION IN MULTI-CARRIER SYSTEM LG ELECTRONICS INC. (KR) 2011-12-29 US disclosed
US-20110317628-A1 METHOD OF PERFORMING WIRELESS COMMUNICATION IN MULTI-CARRIER SYSTEM LG ELECTRONICS INC. (KR) 2011-12-29 US disclosed
US-20040122001-A1 Pharmaceutical compounds ELI LILLY AND COMPANY 2004-06-24 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 (5 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-20170335191-A1 LIQUID CRYSTAL COMPOSITION RCC1, CCDC47, ACIN1 GPR35 3861/4885HDAC3 4592/4885HDAC4 3570/4885
US-20120059140-A1 DIKETOPYRROLOPYRROLE POLYMERS FOR USE IN ORGANIC SEMICONDUCTOR DEVICES MARK1, SKP1, AK1 GPR35 2740/4885HDAC3 4299/4885HDAC4 3670/4885
US-20040122001-A1 Pharmaceutical compounds CYP2D6, LPXN, CYP1B1 GPR35 2223/4885HDAC3 2866/4885HDAC4 2949/4885
US-10407619-B2 Liquid crystal composition RCC1, CCDC47, ACIN1 GPR35 3861/4885HDAC3 4592/4885HDAC4 3570/4885
US-10177313-B2 Diketopyrrolopyrrole polymers for use in organic semiconductor devices MARK1, SKP1, AK1 GPR35 2740/4885HDAC3 4299/4885HDAC4 3670/4885

“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.