SCHEMBL13836221

SCHEMBL13836221

Oc1c(C(Nc2ccccn2)c2ccc(Cl)cc2)ccc2cccnc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P4HB P07237 7/20 1.00
TP53 P04637 5/20 0.82
JMJD7 P0C870 1/20 0.82
CYP2D6 P10635 1/20 0.82
CYP2C9 P11712 1/20 0.82
CYP2C19 P33261 1/20 0.82
HIF1A Q16665 1/20 0.82
HSD17B10 Q99714 1/20 0.82
MAPT P10636 4/20 0.79
SMN1; SMN2 Q16637 3/20 0.79
TEAD4 Q15561 1/20 0.79
MDM2 Q00987 5/20 0.76
GRK6 P43250 1/20 0.72
KDM4E B2RXH2 2/20 0.71
TDP1 Q9NUW8 2/20 0.71
USP2 O75604 2/20 0.71
LMNA P02545 2/20 0.71
ALOX15 P16050 1/20 0.71
NFKB1 P19838 1/20 0.71
MAPK1 P28482 1/20 0.71

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
SCHEMBL5090192 0.90 TP53 (1.00) P4HBTP53JMJD7CYP2D6CYP2C9
SCHEMBL9965609 0.90 P4HB (0.81) P4HBTP53JMJD7CYP2D6CYP2C9
SCHEMBL9965528 0.90 MDM2 (0.83) P4HBTP53JMJD7CYP2D6CYP2C9
SCHEMBL23854803 0.88 TP53 (0.82) P4HBTP53JMJD7CYP2D6CYP2C9
SCHEMBL15783085 0.88 TP53 (0.82) P4HBTP53JMJD7CYP2D6CYP2C9
SCHEMBL13836461 0.88 P4HB (1.00) P4HBTP53JMJD7CYP2D6CYP2C9
SCHEMBL9965758 0.88 MDM2 (0.79) P4HBTP53JMJD7CYP2D6CYP2C9
SCHEMBL2153383 0.88 MAPT (0.83) P4HBTP53JMJD7CYP2D6CYP2C9
SCHEMBL21842247 0.87 P4HB (0.77) P4HBTP53JMJD7CYP2D6CYP2C9
SCHEMBL15783090 0.87 SMN1; SMN2 (0.81) P4HBTP53JMJD7CYP2D6CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3079697-B1 PROLYLHYDROXYLASE/ATF4 INHIBITORS FOR TREATING NEURAL CELL INJURY UNIV CORNELL (US) 2021-02-03 EP disclosed
US-20200360366-A1 PROLYLHYDROXYLASE/ATF4 INHIBITORS AND METHODS OF USE FOR TREATING NEURAL CELL INJURY OR DEATH AND CONDITIONS RESULTING THEREFROM CORNELL UNIVERSITY (US) 2020-11-19 US disclosed
US-10716783-B2 Prolylhydroxylase/ATF4 inhibitors and methods of use for treating neural cell injury or death and conditions resulting therefrom CORNELL UNIVERSITY (US) 2020-07-21 US disclosed
US-20160317526-A1 PROLYLHYDROXYLASE/ATF4 INHIBITORS AND METHODS OF USE FOR TREATING NEURAL CELL INJURY OR DEATH AND CONDITIONS RESULTING THEREFROM CORNELL UNIVERSITY (US) 2016-11-03 US disclosed
WO-2015089416-A1 PROLYLHYDROXYLASE/ATF4 INHIBITORS FOR TREATING NEURAL CELL INJURY CORNELL UNIVERSITY (US) 2015-06-18 WO disclosed
US-20120295890-A1 GLYCOSAMINOGLYCAN INHIBITORS Zacharon Pharmaceutical, Inc. (US) 2012-11-22 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 (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-20200360366-A1 PROLYLHYDROXYLASE/ATF4 INHIBITORS AND METHODS OF USE FOR TREATING NEURAL CELL INJURY OR DEATH AND CONDITIONS RESULTING THEREFROM ATF4, P4HTM, P4HA1 P4HB 104/4885TP53 2913/4885JMJD7 2485/4885
US-20120295890-A1 GLYCOSAMINOGLYCAN INHIBITORS CSGALNACT1, FUT5, ST3GAL3 P4HB 590/4885TP53 3840/4885JMJD7 2515/4885
US-20160317526-A1 PROLYLHYDROXYLASE/ATF4 INHIBITORS AND METHODS OF USE FOR TREATING NEURAL CELL INJURY OR DEATH AND CONDITIONS RESULTING THEREFROM HIF1AN, EGLN3, EGLN2 P4HB 166/4885TP53 2633/4885JMJD7 2274/4885
US-10716783-B2 Prolylhydroxylase/ATF4 inhibitors and methods of use for treating neural cell injury or death and conditions resulting therefrom HIF1AN, EGLN3, EGLN2 P4HB 166/4885TP53 2633/4885JMJD7 2274/4885

“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.