SCHEMBL20564985

SCHEMBL20564985

CC(C)c1c(O)nc(-n2ccnc2)nc1-n1ccnc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 3/20 0.40
LMNA P02545 3/20 0.40
USP2 O75604 2/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
TSHR P16473 8/20 0.39
NPC1 O15118 1/20 0.39
HSD17B10 Q99714 1/20 0.39
MAPK1 P28482 3/20 0.38
CYP3A4 P08684 3/20 0.38
CYP1A2 P05177 2/20 0.38
CYP2D6 P10635 2/20 0.38
CYP2C9 P11712 2/20 0.38
CYP2C19 P33261 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
CD38 P28907 5/20 0.37
ENPP2 Q13822 1/20 0.37
MKNK1 Q9BUB5 1/20 0.37
MKNK2 Q9HBH9 1/20 0.37

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
SCHEMBL20564288 0.85 NPSR1 (0.40) NPSR1LMNAUSP2MEN1KMT2A
SCHEMBL20958055 0.81 CYP3A4 (0.35) NPSR1LMNAUSP2MEN1KMT2A
SCHEMBL20564999 0.81 TSHR (0.39) NPSR1LMNAUSP2MEN1KMT2A
SCHEMBL20957843 0.78 NPSR1 (0.54) NPSR1LMNAUSP2MEN1KMT2A
SCHEMBL20958073 0.75 KDM5B (0.42) NPSR1LMNAUSP2MEN1KMT2A
SCHEMBL20957909 0.75 KDM5B (0.41) NPSR1LMNAUSP2MEN1KMT2A
SCHEMBL20958046 0.75 CYP3A4 (0.46) NPSR1LMNAUSP2MEN1KMT2A
SCHEMBL20980537 0.74 KDM4E (0.49) NPSR1LMNAUSP2MEN1KMT2A
SCHEMBL20564951 0.74 CD38 (0.40) NPSR1LMNAUSP2MEN1KMT2A
SCHEMBL20958128 0.74 KDM5B (0.41) NPSR1LMNAUSP2MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190135793-A1 HETEROCYCLIC INHIBITORS OF KDM5 FOR THE TREATMENT OF DISEASE BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2019-05-09 US disclosed
US-20190135793-A1 HETEROCYCLIC INHIBITORS OF KDM5 FOR THE TREATMENT OF DISEASE BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2019-05-09 US disclosed
WO-2018213777-A1 HETEROCYCLIC INHIBITORS OF KDM5 FOR THE TREATMENT OF DISEASE BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2018-11-22 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 (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-20190135793-A1 HETEROCYCLIC INHIBITORS OF KDM5 FOR THE TREATMENT OF DISEASE KDM5A, KDM5B, KDM5C NPSR1 4827/4885LMNA 1984/4885USP2 446/4885

“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.