SCHEMBL8407853

SCHEMBL8407853

CCCCc1cc(=O)[nH]c(=S)[nH]1

nearest known ligand 0.90

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.90
LPO P22079 2/20 0.79
MPO P05164 1/20 0.79
TPO P07202 1/20 0.79
TSHR P16473 1/20 0.79
CYP2C19 P33261 1/20 0.79
TAS2R38 P59533 1/20 0.79
GPR84 Q9NQS5 11/20 0.59
MAPT P10636 1/20 0.56
SMN1; SMN2 Q16637 2/20 0.49
PTGS1 P23219 1/20 0.47
ALDH1A1 P00352 1/20 0.45
CYB5R3 P00387 1/20 0.45
CYP3A4 P08684 1/20 0.45
DAO P14920 1/20 0.44
FFAR3 O14843 1/20 0.43
FFAR2 O15552 1/20 0.43
HCAR2 Q8TDS4 1/20 0.43
BAZ2B Q9UIF8 1/20 0.42

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
SCHEMBL10489579 0.95 KMT2A (1.00) KMT2ALPOMPOTPOTSHR
SCHEMBL11739128 0.93 KMT2A (0.97) KMT2ALPOMPOTPOTSHR
SCHEMBL15752987 0.93 KMT2A (0.97) KMT2ALPOMPOTPOTSHR
SCHEMBL29948466 0.93 KMT2A (0.97) KMT2ALPOMPOTPOTSHR
SCHEMBL6996841 0.93 KMT2A (0.97) KMT2ALPOMPOTPOTSHR
SCHEMBL11736351 0.93 KMT2A (0.97) KMT2ALPOMPOTPOTSHR
Propylthiouracil SCHEMBL5493716 0.89 LPO (1.00) KMT2ALPOMPOTPOTSHR
Propylthiouracil SCHEMBL41239 0.89 LPO (1.00) KMT2ALPOMPOTPOTSHR
Propylthiouracil SCHEMBL27995248 0.87 LPO (0.96) KMT2ALPOMPOTPOTSHR
SCHEMBL11582733 0.86 KMT2A (0.82) KMT2ALPOMPOTPOTSHR

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
US-20230293524-A1 OTIC FORMULATIONS FOR DRUG-INDUCED OTOTOXICITY SPIRAL THERAPEUTICS INC. 2023-09-21 US disclosed
WO-2021087408-A1 OTIC FORMULATIONS FOR DRUG-INDUCED OTOTOXICITY OTONOMY, INC. (US) 2021-05-06 WO disclosed
US-10640490-B2 Diaminopyrimidine derivatives and processes for the preparation thereof YUHAN CORPORATION (KR) 2020-05-05 US disclosed
US-20180072705-A1 DIAMINOPYRIMIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORPORATION (KR) 2018-03-15 US disclosed
US-9850227-B2 Diaminopyrimidine derivatives and processes for the preparation thereof YUHAN CORPORATION (KR) 2017-12-26 US disclosed
EP-2678331-B1 DIAMINOPYRIMIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORP (KR) 2016-04-27 EP disclosed
EP-2678331-A2 DIAMINOPYRIMIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF Yuhan Corporation (KR) 2014-01-01 EP disclosed
US-20130331377-A1 DIAMINOPYRIMIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORPORATION (KR) 2013-12-12 US disclosed
WO-2012115479-A2 DIAMINOPYRIMIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORPORATION (KR) 2012-08-30 WO disclosed
WO-2012115478-A2 DIAMINOPYRIMIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORPORATION (KR) 2012-08-30 WO disclosed
EP-0930534-A1 A black-white image forming method KONICA CORPORATION (JP) 1999-07-21 EP 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 (4 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-20130331377-A1 DIAMINOPYRIMIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF HRH2, GIPR, SSTR4 KMT2A 4017/4885LPO 2130/4885MPO 3541/4885
US-10640490-B2 Diaminopyrimidine derivatives and processes for the preparation thereof HRH2, GIPR, SSTR4 KMT2A 4017/4885LPO 2130/4885MPO 3541/4885
US-20180072705-A1 DIAMINOPYRIMIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF HRH2, GIPR, SSTR4 KMT2A 4017/4885LPO 2130/4885MPO 3541/4885
US-20230293524-A1 OTIC FORMULATIONS FOR DRUG-INDUCED OTOTOXICITY OTC, SLC26A4, OAT KMT2A 4008/4885LPO 874/4885MPO 962/4885

“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.