SCHEMBL178974

SCHEMBL178974

O=C1NC(c2cc3sccc3s2)=C2C(=O)NC(c3cc4sccc4s3)=C12

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GPR35 Q9HC97 1/20 0.40
HDAC3 O15379 1/20 0.38
HDAC4 P56524 1/20 0.38
HDAC1 Q13547 1/20 0.38
HDAC7 Q8WUI4 1/20 0.38
HDAC2 Q92769 1/20 0.38
HDAC10 Q969S8 1/20 0.38
HDAC11 Q96DB2 1/20 0.38
HDAC8 Q9BY41 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
HDAC9 Q9UKV0 1/20 0.38
HDAC5 Q9UQL6 1/20 0.38
GAA P10253 3/20 0.36
ALDH1A1 P00352 1/20 0.36
POLB P06746 1/20 0.33
TLK2 Q86UE8 1/20 0.33
GLA P06280 1/20 0.31
L3MBTL1 Q9Y468 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
SCHEMBL14757447 0.94 GPR35 (0.36) GPR35HDAC3HDAC4HDAC1HDAC7
SCHEMBL12264644 0.90 GPR35 (0.40) GPR35HDAC3HDAC4HDAC1HDAC7
SCHEMBL15715104 0.75 GPR35 (0.34) GPR35HDAC3HDAC4HDAC1HDAC7
SCHEMBL845679 0.74 GPR35 (0.50) GPR35HDAC3HDAC4HDAC1HDAC7
SCHEMBL12264654 0.74 CYP2A6 (0.33)
SCHEMBL178966 0.72 APP (0.45)
SCHEMBL12264643 0.70 GAA (0.38) GPR35HDAC3HDAC4HDAC1HDAC7
SCHEMBL12073935 0.68 GPR35 (0.41) GPR35HDAC3HDAC4HDAC1HDAC7
SCHEMBL167973 0.68 SLC6A11 (0.44) ALDH1A1POLBGLAL3MBTL1
SCHEMBL12606487 0.67 GPR35 (0.38) GPR35HDAC3HDAC4HDAC1HDAC7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10177313-B2 Diketopyrrolopyrrole polymers for use in organic semiconductor devices BASF SE (DE) 2019-01-08 US disclosed
US-20170005270-A1 DIKETOPYRROLOPYRROLE POLYMERS FOR USE IN ORGANIC SEMICONDUCTOR DEVICES CLAP CO., LTD. (KR) 2017-01-05 US disclosed
US-9478745-B2 Diketopyrrolopyrrole polymers for use in organic semiconductor devices BASF SE (DE) 2016-10-25 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-8598449-B2 Conjugated polymers and their use in optoelectronic devices POLYERA CORPORATION (US) 2013-12-03 US disclosed
US-20120187385-A1 Conjugated Polymers and Their Use in Optoelectronic Devices RAYNERGY TEK INC. (TW) 2012-07-26 US disclosed
US-20120187385-A1 Conjugated Polymers and Their Use in Optoelectronic Devices RAYNERGY TEK INC. (TW) 2012-07-26 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-7977670-B2 Organic transistor TOYO INK MFG. CO., LTD. (JP) 2011-07-12 US disclosed
US-7977670-B2 Organic transistor TOYO INK MFG. CO., LTD. (JP) 2011-07-12 US disclosed
WO-2010135723-A2 CONJUGATED POLYMERS AND THEIR USE IN OPTOELECTRONIC DEVICES POLYERA CORPORATION (US) 2010-11-25 WO disclosed
WO-2010135723-A2 CONJUGATED POLYMERS AND THEIR USE IN OPTOELECTRONIC DEVICES POLYERA CORPORATION (US) 2010-11-25 WO disclosed
WO-2010108873-A1 DIKETOPYRROLOPYRROLE POLYMERS FOR USE IN ORGANIC SEMICONDUCTOR DEVICES BASF SE (DE) 2010-09-30 WO disclosed
US-20100032657-A1 ORGANIC TRANSISTOR TOYO INK MFG CO., LTD (JP) 2010-02-11 US disclosed
US-20100032657-A1 ORGANIC TRANSISTOR TOYO INK MFG CO., LTD (JP) 2010-02-11 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 (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-20120059140-A1 DIKETOPYRROLOPYRROLE POLYMERS FOR USE IN ORGANIC SEMICONDUCTOR DEVICES MARK1, SKP1, AK1 GPR35 2740/4885HDAC3 4299/4885HDAC4 3670/4885
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.