SCHEMBL1684499

SCHEMBL1684499

CC(=O)c1c(C)nc2ncccn12

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 9/20 0.67
ALDH1A1 P00352 7/20 0.67
HPGD P15428 6/20 0.67
HSD17B10 Q99714 2/20 0.67
KMT2A Q03164 2/20 0.55
AR P10275 1/20 0.41
CYP1A2 P05177 3/20 0.41
MAPT P10636 5/20 0.39
NTRK1 P04629 1/20 0.39
GPBAR1 Q8TDU6 1/20 0.39
GAA P10253 4/20 0.38
LMNA P02545 2/20 0.38
MAPK1 P28482 1/20 0.38
HTT P42858 1/20 0.38
POLB P06746 1/20 0.38
PKM P14618 1/20 0.38
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37
ALOX12 P18054 1/20 0.37
CYP2C19 P33261 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
SCHEMBL17745192 0.87 KDM4E (0.67) KDM4EALDH1A1HPGDHSD17B10KMT2A
SCHEMBL16678533 0.85 KDM4E (0.65) KDM4EALDH1A1HPGDHSD17B10KMT2A
SCHEMBL18902039 0.83 KDM4E (0.70) KDM4EALDH1A1HPGDHSD17B10KMT2A
SCHEMBL1684384 0.81 ALDH1A1 (0.64) KDM4EALDH1A1HPGDHSD17B10KMT2A
Bromide SCHEMBL2337105 0.80 ALDH1A1 (0.63) KDM4EALDH1A1HPGDHSD17B10KMT2A
SCHEMBL17324742 0.80 ALDH1A1 (0.55) KDM4EALDH1A1HPGDHSD17B10KMT2A
SCHEMBL26056366 0.77 ALDH1A1 (0.66) KDM4EALDH1A1HPGDHSD17B10CYP1A2
SCHEMBL1684439 0.77 ALDH1A1 (0.55) KDM4EALDH1A1HPGDHSD17B10KMT2A
SCHEMBL1684435 0.77 ALDH1A1 (0.55) KDM4EALDH1A1HPGDHSD17B10KMT2A
SCHEMBL22817541 0.77 ALDH1A1 (0.48) KDM4EALDH1A1HPGDHSD17B10KMT2A

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 38 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10875861-B1 Therapeutic compounds RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2020-12-29 US disclosed
EP-3111956-B1 BMI 1 PROTEIN EXPRESSION MODULATORS PTC THERAPEUTICS INC (US) 2019-05-08 EP disclosed
EP-3111956-B1 BMI 1 PROTEIN EXPRESSION MODULATORS PTC THERAPEUTICS INC (US) 2019-05-08 EP disclosed
EP-3173414-A1 HETEROCYCLIC COMPOUNDS AND USES AS ANTICANCER AGENTS ACEA Biosciences Inc. (US) 2017-05-31 EP disclosed
EP-3173414-A1 HETEROCYCLIC COMPOUNDS AND USES AS ANTICANCER AGENTS ACEA Biosciences Inc. (US) 2017-05-31 EP disclosed
EP-2188271-B1 HETEROCYCLIC COMPOUNDS AND USES AS ANTICANCER AGENTS ACEA BIOSCIENCES INC (US) 2017-01-11 EP disclosed
EP-2188271-B1 HETEROCYCLIC COMPOUNDS AND USES AS ANTICANCER AGENTS ACEA BIOSCIENCES INC (US) 2017-01-11 EP disclosed
EP-3111956-A1 BMI 1 PROTEIN EXPRESSION MODULATORS PTC Therapeutics, Inc. (US) 2017-01-04 EP disclosed
EP-3111956-A1 BMI 1 PROTEIN EXPRESSION MODULATORS PTC Therapeutics, Inc. (US) 2017-01-04 EP disclosed
EP-2306836-B1 BMI-1 PROTEIN EXPRESSION MODULATORS PTC THERAPEUTICS INC (US) 2016-09-07 EP disclosed
EP-2188271-A2 HETEROCYCLIC COMPOUNDS AND USES AS ANTICANCER AGENTS Acea Biosciences, Inc. (US) 2010-05-26 EP disclosed
US-20100029638-A1 FUSED HETEROCYCLYC INHIBITOR COMPOUNDS GILEAD SCIENCES, INC. 2010-02-04 US disclosed
US-20100029638-A1 FUSED HETEROCYCLYC INHIBITOR COMPOUNDS GILEAD SCIENCES, INC. 2010-02-04 US disclosed
WO-2010009155-A2 FUSED HETEROCYCLYC INHIBITOR COMPOUNDS GILEAD COLORADO, INC. (US) 2010-01-21 WO disclosed
WO-2010002985-A1 BMI-1 PROTEIN EXPRESSION MODULATORS PTC THERAPEUTICS, INC. (US) 2010-01-07 WO disclosed
WO-2010002985-A1 BMI-1 PROTEIN EXPRESSION MODULATORS PTC THERAPEUTICS, INC. (US) 2010-01-07 WO disclosed
WO-2009023402-A2 HETEROCYCLIC COMPOUNDS AND USES AS ANTICANCER AGENTS ACEA BIOSCIENCES INC. (US) 2009-02-19 WO disclosed
WO-2009023402-A2 HETEROCYCLIC COMPOUNDS AND USES AS ANTICANCER AGENTS ACEA BIOSCIENCES INC. (US) 2009-02-19 WO disclosed
US-20090048271-A1 HETEROCYCLIC COMPOUNDS AND USES AS ANTICANCER AGENTS ACEA Therapeutics, Inc. 2009-02-19 US disclosed
US-20090048271-A1 HETEROCYCLIC COMPOUNDS AND USES AS ANTICANCER AGENTS ACEA Therapeutics, Inc. 2009-02-19 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 (3 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-20100029638-A1 FUSED HETEROCYCLYC INHIBITOR COMPOUNDS HDAC1, HDAC11, HDAC7 KDM4E 483/4885ALDH1A1 2855/4885HPGD 1399/4885
US-20090048271-A1 HETEROCYCLIC COMPOUNDS AND USES AS ANTICANCER AGENTS MKI67, CCNC, HCCS KDM4E 2327/4885ALDH1A1 961/4885HPGD 231/4885
US-10875861-B1 Therapeutic compounds H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, TP53, RB1 KDM4E 696/4885ALDH1A1 1847/4885HPGD 4223/4885

“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.