SCHEMBL13858409

SCHEMBL13858409

Cc1cn(-c2ccccc2)nc1C(N)=O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.55
PKM P14618 2/20 0.55
LMNA P02545 2/20 0.55
ADORA3 P0DMS8 1/20 0.55
ADORA2A P29274 1/20 0.55
ADORA2B P29275 1/20 0.55
ADORA1 P30542 1/20 0.55
KAT2B Q92831 1/20 0.55
ALDH1A1 P00352 4/20 0.51
NPC1 O15118 4/20 0.51
RAB9A P51151 4/20 0.51
GAA P10253 3/20 0.51
MAPT P10636 2/20 0.51
POLB P06746 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
PARP1 P09874 1/20 0.50
PARP2 Q9UGN5 1/20 0.50
PARP3 Q9Y6F1 1/20 0.50
KMT2A Q03164 4/20 0.49
MEN1 O00255 2/20 0.49

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
SCHEMBL4302959 0.86 CYP2C9 (0.56) KDM4EALDH1A1NPC1RAB9AGAA
SCHEMBL16217008 0.85 NPC1 (0.52) KDM4ELMNAADORA3ALDH1A1NPC1
SCHEMBL6261500 0.83 SLC9A1 (0.49) KDM4EPKMLMNAADORA3ADORA2A
Hydrochloric Acid SCHEMBL6313073 0.82 SLC9A1 (0.48) KDM4EPKMLMNAADORA3ADORA2A
SCHEMBL3568441 0.81 ALDH1A1 (0.54) KDM4EPKMLMNAADORA3ADORA2A
SCHEMBL6313558 0.81 ALDH1A1 (0.50) KDM4EPKMLMNAADORA3ADORA2A
SCHEMBL29794622 0.81 DGAT1 (0.55) KDM4ELMNAALDH1A1NPC1RAB9A
SCHEMBL17239570 0.81 ALDH1A1 (0.52) KDM4EPKMLMNAADORA3ADORA2A
Hydrochloric Acid SCHEMBL6313068 0.80 DGAT1 (0.49) KDM4EPKMLMNAADORA3ADORA2A
SCHEMBL13860921 0.80 KMT2A (0.67) KDM4EPKMLMNAADORA3ADORA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021072238-A1 FEEDER-BASED AND FEEDER-FREE STEM CELL CULTURE SYSTEMS FOR STRATIFIED EPITHELIAL STEM CELLS, AND USES RELATED THERETO UNIVERSITY OF HOUSTON SYSTEM (US) 2021-04-15 WO disclosed
CN-108329246-B Pyrrolidinyl urea and pyrrolidinyl thiourea compounds as TRKA kinase inhibitors 阵列生物制药公司 2021-02-26 CN disclosed
US-9796711-B2 Substituted pyrazolo[3,4-b]pyridin-6-carboxylic acids and method of use ABBVIE S.Á.R.L. (LU) 2017-10-24 US disclosed
US-20170101406-A1 SUBSTITUTED PYRAZOLO[3,4-b]PYRIDIN-6-CARBOXYLIC ACIDS AND METHOD OF USE ABBVIE OVERSEAS S.Á.R.L. (LU) 2017-04-13 US disclosed
EP-3140298-A1 TROPOMYOSIN-RELATED KINASE INHIBITORS Pfizer Inc. (US) 2017-03-15 EP disclosed
US-9328096-B2 Tropomyosin-related kinase inhibitors PFIZER INC. (US) 2016-05-03 US disclosed
WO-2015170218-A1 TROPOMYOSIN-RELATED KINASE INHIBITORS PFIZER INC. (US) 2015-11-12 WO disclosed
US-20150322043-A1 TROPOMYOSIN-RELATED KINASE INHIBITORS PFIZER (US) 2015-11-12 US disclosed
WO-2012158413-A2 PYRROLIDINYL UREA AND PYRROLIDINYL THIOUREA COMPOUNDS AS TRKA KINASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2012-11-22 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 (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-20170101406-A1 SUBSTITUTED PYRAZOLO[3,4-b]PYRIDIN-6-CARBOXYLIC ACIDS AND METHOD OF USE CFTR, CHRM3, P2RY1 KDM4E 4749/4885PKM 1040/4885LMNA 4686/4885
US-20150322043-A1 TROPOMYOSIN-RELATED KINASE INHIBITORS TPM3, MUSK, TPM4 KDM4E 2614/4885PKM 892/4885LMNA 2061/4885

“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.