SCHEMBL290282

SCHEMBL290282

NCCc1sc(-c2cccnc2)nc1Cl

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
KDM4E B2RXH2 4/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
ALOX5 P09917 1/20 0.43
MAPT P10636 2/20 0.43
ALDH1A1 P00352 1/20 0.43
POLB P06746 1/20 0.43
CYP2A6 P11509 7/20 0.43
CYP3A4 P08684 4/20 0.43
CYP2C19 P33261 3/20 0.43
CYP2E1 P05181 3/20 0.43
CYP2C9 P11712 3/20 0.43
CYP2B6 P20813 3/20 0.43
CYP2D6 P10635 2/20 0.43
LMNA P02545 1/20 0.43
CYP1A2 P05177 1/20 0.43
GFER P55789 1/20 0.43
CHRNA7 P36544 1/20 0.42
CYP19A1 P11511 2/20 0.41

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
Hydrochloric Acid SCHEMBL290179 0.99 NPC1 (0.44) NPC1RAB9AKDM4ESMN1; SMN2ALOX5
SCHEMBL289944 0.88 CYP2A6 (0.53) NPC1RAB9AKDM4ESMN1; SMN2ALOX5
SCHEMBL16601902 0.77 KDM4E (0.54) NPC1RAB9AKDM4ESMN1; SMN2ALOX5
SCHEMBL14141885 0.77 ALOX5 (0.59) NPC1RAB9AKDM4ESMN1; SMN2ALOX5
Hydrochloric Acid SCHEMBL31734146 0.76 KDM4E (0.53) NPC1RAB9AKDM4ESMN1; SMN2ALOX5
SCHEMBL14141735 0.74 RAB9A (0.51) NPC1RAB9AKDM4ESMN1; SMN2ALOX5
SCHEMBL12040235 0.74 CYP3A4 (0.53) NPC1RAB9AKDM4ESMN1; SMN2ALOX5
SCHEMBL29828863 0.74 CYP3A4 (0.58) NPC1RAB9AKDM4ESMN1; SMN2ALOX5
SCHEMBL15626275 0.71 CYP1A2 (0.71) NPC1RAB9AKDM4ESMN1; SMN2ALOX5
SCHEMBL13074523 0.71 NPC1 (0.48) NPC1RAB9AKDM4ESMN1; SMN2ALOX5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2614826-B1 Process for preparation of thiazole derivatives DOW AGROSCIENCES LLC (US) 2017-03-01 EP disclosed
US-9357780-B2 Pesticidal compositions DOW AGROSCIENCES LLC (US) 2016-06-07 US disclosed
EP-2614825-B1 Process for the preparation of thiazole derivatives DOW AGROSCIENCES LLC (US) 2016-03-16 EP disclosed
EP-2427191-B1 PESTICIDAL COMPOSITIONS DOW AGROSCIENCES LLC (US) 2016-03-16 EP disclosed
EP-2604267-B1 Process for the preparation of thiazole derivatives DOW AGROSCIENCES LLC (US) 2016-02-03 EP disclosed
EP-2604268-B1 Process for the preparation of thiazole derivatives DOW AGROSCIENCES LLC (US) 2015-09-16 EP disclosed
US-9006446-B2 Pesticidal compositions DOW AGROSCIENCES LLC (US) 2015-04-14 US disclosed
US-20150045218-A1 PESTICIDAL COMPOSITIONS DOW AGROSCIENCES LLC (US) 2015-02-12 US disclosed
US-20140348947-A1 PESTICIDAL COMPOSITIONS DOW AGROSCIENCES LLC (US) 2014-11-27 US disclosed
US-8853246-B2 Pesticidal compositions DOW AGROSCIENCES, LLC. (US) 2014-10-07 US disclosed
EP-2614825-A1 Process for the preparation of thiazole derivatives Dow AgroSciences LLC (US) 2013-07-17 EP disclosed
EP-2614826-A1 Process for preparation of thiazole derivatives Dow AgroSciences LLC (US) 2013-07-17 EP disclosed
EP-2604267-A1 Process for the preparation of thiazole derivatives Dow AgroSciences LLC (US) 2013-06-19 EP disclosed
EP-2604268-A1 Process for the preparation of thiazole derivatives Dow AgroSciences LLC (US) 2013-06-19 EP disclosed
US-20130089622-A1 PESTICIDAL COMPOSITIONS DOW AGROSCIENCES LLC (US) 2013-04-11 US disclosed
US-20130072382-A1 PESTICIDAL COMPOSITIONS DOW AGROSCIENCES LLC (US) 2013-03-21 US disclosed
US-8350044-B2 Pesticidal compositions DOW AGROSCIENCES, LLC. (US) 2013-01-08 US disclosed
EP-2427191-A1 PESTICIDAL COMPOSITIONS Dow AgroSciences LLC (US) 2012-03-14 EP disclosed
US-20100292253-A1 PESTICIDAL COMPOSITIONS DOW AGROSCIENCES LLC (US) 2010-11-18 US disclosed
WO-2010129497-A1 PESTICIDAL COMPOSITIONS DOW AGROSCIENCES LLC (US) 2010-11-11 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 (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-20100292253-A1 PESTICIDAL COMPOSITIONS ACHE, DDT, PRDX6 NPC1 3536/4885RAB9A 357/4885KDM4E 3250/4885
US-20130089622-A1 PESTICIDAL COMPOSITIONS ACHE, DDT, PRDX6 NPC1 3536/4885RAB9A 357/4885KDM4E 3250/4885
US-20140348947-A1 PESTICIDAL COMPOSITIONS ACHE, DDT, PRDX6 NPC1 3536/4885RAB9A 357/4885KDM4E 3250/4885
US-20150045218-A1 PESTICIDAL COMPOSITIONS ACHE, DDT, PRDX6 NPC1 3536/4885RAB9A 357/4885KDM4E 3250/4885
US-20130072382-A1 PESTICIDAL COMPOSITIONS ACHE, DDT, PRDX6 NPC1 3536/4885RAB9A 357/4885KDM4E 3250/4885

“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.