SCHEMBL15052258

SCHEMBL15052258

CCCCCCCCCCCCCCCCCCCCc1cc(-c2ccc(-c3cc(CCCCCCCCCCCCCCCCCCCC)c(Br)s3)c3nc(-c4ccccc4)c(-c4ccccc4)nc23)sc1Br

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GPR84 Q9NQS5 1/20 0.43
▸ DHFR P00374 1/20 0.38
▸ SOAT1 P35610 3/20 0.37
▸ MEN1 O00255 2/20 0.37
▸ MAPT P10636 2/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ APAF1 O14727 1/20 0.37
▸ USP2 O75604 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ ESR1 P03372 1/20 0.37
▸ GAA P10253 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ CACNA1B Q00975 1/20 0.37
▸ APBA1 Q02410 1/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.37
▸ GPR3 P46089 1/20 0.36
▸ TP53 P04637 1/20 0.36

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
SCHEMBL12131282 1.00 GPR84 (0.43) GPR84DHFRSOAT1MEN1MAPT
SCHEMBL15051799 1.00 GPR84 (0.43) GPR84DHFRSOAT1MEN1MAPT
SCHEMBL15052877 0.91 KDM4E (0.40) MEN1MAPTKMT2ASMN1; SMN2KDM4E
SCHEMBL15052095 0.87 RARB (0.38) MEN1MAPTKMT2ASMN1; SMN2KDM4E
SCHEMBL15051715 0.85 KCNH2 (0.34) DHFRMEN1MAPTKMT2AHTT
SCHEMBL12715533 0.84 ADK (0.41) DHFRMEN1KMT2AKDM4EALDH1A1
SCHEMBL12610448 0.82 PSMB5 (0.41) GPR84SOAT1MAPTHPGDTP53
SCHEMBL4585885 0.81 GPR84 (0.43) GPR84SOAT1MEN1MAPTKMT2A
SCHEMBL12715545 0.81 PTGES (0.39) MAPTALDH1A1HPGD
SCHEMBL15052197 0.81 TYR (0.31) GPR84MEN1MAPTKMT2AHTT

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
EP-2615095-B1 BENZODITHIOPHENE ORGANIC SEMICONDUCTIVE MATERIAL, PREPARATION METHOD AND USE THEREOF OCEANS KING LIGHTING SCIENCE (CN) 2015-11-04 — — EP disclosed
US-8557987-B2 Benzodithiophene organic semiconductive material and its preparation method and use OCEAN'S KING LIGHTING SCIENCE & TECHNOLOGY CO., LTD. (CN) 2013-10-15 — — US disclosed
EP-2615095-A1 BENZODITHIOPHENE ORGANIC SEMICONDUCTIVE MATERIAL, PREPARATION METHOD AND USE THEREOF Ocean's King Lighting Science&Technology Co., Ltd. (CN) 2013-07-17 — — EP disclosed
US-20130165655-A1 BENZODITHIOPHENE ORGANIC SEMICONDUCTIVE MATERIAL AND ITS PREPARATION METHOD AND USE OCEAN'S KING LIGHTING SCIENCE & TECHNOLOGY CO., LTD. (CN) 2013-06-27 — — 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 (1 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-20130165655-A1 BENZODITHIOPHENE ORGANIC SEMICONDUCTIVE MATERIAL AND ITS PREPARATION METHOD AND USE CCNT1, CCNE2, SULT1A1 GPR84 3285/4885DHFR 2687/4885SOAT1 969/4885

“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.

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