SCHEMBL26802012

SCHEMBL26802012

CNCc1cc(C)cc(CNC)c1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.44
CYP3A4 P08684 1/20 0.44
MAPT P10636 1/20 0.44
PGK1 P00558 1/20 0.39
PGK2 P07205 1/20 0.39
LOXL2 Q9Y4K0 1/20 0.39
PRMT6 Q96LA8 8/20 0.35
NCF1 P14598 1/20 0.34
NOS1 P29475 4/20 0.34
HTR7 P34969 2/20 0.34
NOS3 P29474 3/20 0.33
NOS2 P35228 1/20 0.33
EPHX2 P34913 1/20 0.33

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
SCHEMBL4832407 0.94 KDM4E (0.44) KDM4ECYP3A4MAPTPGK1PGK2
Hydrochloric Acid SCHEMBL5705745 0.92 KDM4E (0.48) KDM4ECYP3A4MAPTPGK1PGK2
SCHEMBL22446844 0.91 NOS1 (0.39) KDM4ECYP3A4MAPTPGK1PGK2
SCHEMBL13339967 0.88 KDM4E (0.52) KDM4ECYP3A4MAPTLOXL2PRMT6
SCHEMBL23265420 0.84 ALDH1A1 (0.52) KDM4ECYP3A4MAPTLOXL2NOS1
SCHEMBL11983503 0.84 NOS1 (0.43) KDM4ECYP3A4MAPTLOXL2NOS1
SCHEMBL6907497 0.84 TACR1 (0.38) KDM4ECYP3A4MAPTLOXL2PRMT6
Hydrochloric Acid SCHEMBL6913331 0.82 KDM4E (0.40) KDM4ECYP3A4MAPTLOXL2PRMT6
SCHEMBL12765145 0.80 NOS1 (0.43) NOS1NOS3NOS2
SCHEMBL14043315 0.80 TSHR (0.43) KDM4ENOS1HTR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230381327-A1 REACTIVE CONJUGATES DEBIOPHARM RESEARCH & MANUFACTURING S.A. (CH) 2023-11-30 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-20230381327-A1 REACTIVE CONJUGATES FCGR3B, FCGR1A, FCGR2A KDM4E 3268/4885CYP3A4 2290/4885MAPT 66/4885

“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.