SCHEMBL2363930

SCHEMBL2363930

CCCCCN1C=CSC1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C19 P33261 1/20 0.32
PTGS1 P23219 3/20 0.31
PTGS2 P35354 3/20 0.31
MGLL Q99685 3/20 0.31
FAAH O00519 2/20 0.31
TP53 P04637 1/20 0.31
HSP90AA1 P07900 1/20 0.31
CYP3A4 P08684 1/20 0.31
G6PD P11413 1/20 0.31
HPGD P15428 1/20 0.31
ALOX15 P16050 1/20 0.31
TSHR P16473 1/20 0.31
HIF1A Q16665 1/20 0.31
HSD17B10 Q99714 1/20 0.31
GNAI3 P08754 1/20 0.31
GNAO1 P09471 1/20 0.31
GNAI1 P63096 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
SCHEMBL11135652 0.98 PTGS1 (0.34) ALDH1A1CYP1A2CYP2D6CYP2C19PTGS1
SCHEMBL9778326 0.98 PTGS1 (0.34) ALDH1A1CYP1A2CYP2D6CYP2C19PTGS1
SCHEMBL11445710 0.98 PTGS1 (0.34) ALDH1A1CYP1A2CYP2D6CYP2C19PTGS1
SCHEMBL28784387 0.98 PTGS1 (0.34) ALDH1A1CYP1A2CYP2D6CYP2C19PTGS1
Bromide SCHEMBL9154612 0.96 ALDH1A1 (0.37) ALDH1A1CYP1A2CYP2D6CYP2C19PTGS1
Hydrochloric Acid SCHEMBL11175489 0.96 GNAI3 (0.36) ALDH1A1CYP1A2CYP2D6CYP2C19PTGS1
Bromide SCHEMBL8732340 0.96 ALDH1A1 (0.37) ALDH1A1CYP1A2CYP2D6CYP2C19PTGS1
Hydrochloric Acid SCHEMBL11349504 0.96 GNAI3 (0.36) ALDH1A1CYP1A2CYP2D6CYP2C19PTGS1
Hydrochloric Acid SCHEMBL11693496 0.96 GNAI3 (0.36) ALDH1A1CYP1A2CYP2D6CYP2C19PTGS1
Hydrochloric Acid SCHEMBL29156454 0.96 GNAI3 (0.36) ALDH1A1CYP1A2CYP2D6CYP2C19PTGS1

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
EP-2352876-B1 TREATED TEXTILE MATERIAL FOR USE IN AQUATIC ENVIRONMENTS BASF SE (DE) 2012-12-12 EP claimed
US-20110217348-A1 TREATED TEXTILE MATERIAL FOR USE IN AQUATIC ENVIRONMENTS BASF SE (DE) 2011-09-08 US claimed
EP-2352876-A1 TREATED TEXTILE MATERIAL FOR USE IN AQUATIC ENVIRONMENTS BASF SE (DE) 2011-08-10 EP claimed
WO-2010052153-A1 TREATED TEXTILE MATERIAL FOR USE IN AQUATIC ENVIRONMENTS BASF SE (DE) 2010-05-14 WO claimed
WO-2009041790-A1 NOVEL 2,4,5-TRISUBTITUTED-1,3-THIAZOLE DERIVATIVES AND PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, METHOD FOR PREPARATION, THERAPEUTIC AGENT FOR INFLAMMATORY DISEASE INDUCED BY SPC ACTIVITY CONTAINING 2,4,5- TRISUBSTITUTED-1,3-THIAZOLE DERIVATIVES AS AN EFFECTIVE INGREDIENT KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2009-04-02 WO claimed
US-20240231230-A1 COMPOSITION FOR FORMING SILICON-CONTAINING RESIST UNDERLAYER FILM NISSAN CHEMICAL CORPORATION (JP) 2024-07-11 US disclosed
EP-2352876-B1 TREATED TEXTILE MATERIAL FOR USE IN AQUATIC ENVIRONMENTS BASF SE (DE) 2012-12-12 EP disclosed
US-20110217348-A1 TREATED TEXTILE MATERIAL FOR USE IN AQUATIC ENVIRONMENTS BASF SE (DE) 2011-09-08 US disclosed
EP-2352876-A1 TREATED TEXTILE MATERIAL FOR USE IN AQUATIC ENVIRONMENTS BASF SE (DE) 2011-08-10 EP disclosed
WO-2010052153-A1 TREATED TEXTILE MATERIAL FOR USE IN AQUATIC ENVIRONMENTS BASF SE (DE) 2010-05-14 WO disclosed
WO-2009041790-A1 NOVEL 2,4,5-TRISUBTITUTED-1,3-THIAZOLE DERIVATIVES AND PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, METHOD FOR PREPARATION, THERAPEUTIC AGENT FOR INFLAMMATORY DISEASE INDUCED BY SPC ACTIVITY CONTAINING 2,4,5- TRISUBSTITUTED-1,3-THIAZOLE DERIVATIVES AS AN EFFECTIVE INGREDIENT KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2009-04-02 WO 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-20110217348-A1 TREATED TEXTILE MATERIAL FOR USE IN AQUATIC ENVIRONMENTS C9, ADORA2B, C5 ALDH1A1 296/4885CYP1A2 758/4885CYP2D6 1047/4885

“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.