SCHEMBL3470079

SCHEMBL3470079

Cc1cc2nc(NC(=N)N)nc(C)c2cc1C

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 10/20 0.53
MAPT P10636 8/20 0.53
KMT2A Q03164 8/20 0.53
LMNA P02545 5/20 0.53
SMN1; SMN2 Q16637 4/20 0.53
RAB9A P51151 3/20 0.50
RAD52 P43351 1/20 0.50
QRFPR Q96P65 1/20 0.50
NPY2R P49146 1/20 0.41
MEN1 O00255 7/20 0.40
ALOX12 P18054 2/20 0.40
ALDH1A1 P00352 3/20 0.40
HSD17B10 Q99714 1/20 0.39
NPC1 O15118 2/20 0.39
HPGD P15428 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
GAA P10253 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
SCHEMBL7054013 0.89 KDM4E (0.44) KDM4EMAPTKMT2ALMNASMN1; SMN2
SCHEMBL7071371 0.86 KDM4E (0.42) KDM4EMAPTKMT2ALMNASMN1; SMN2
SCHEMBL7057599 0.84 KDM4E (0.40) KDM4EMAPTKMT2ALMNASMN1; SMN2
SCHEMBL3470444 0.81 KDM4E (0.58) KDM4EMAPTKMT2ALMNASMN1; SMN2
SCHEMBL3469723 0.81 KMT2A (0.58) KDM4EMAPTKMT2ALMNASMN1; SMN2
SCHEMBL7073342 0.81 KDM4E (0.38) KDM4EMAPTKMT2ALMNASMN1; SMN2
SCHEMBL24029264 0.79 MPO (0.55) KDM4EMAPTKMT2ALMNASMN1; SMN2
SCHEMBL7053255 0.79 MPO (0.55) KDM4EMAPTKMT2ALMNASMN1; SMN2
SCHEMBL22833819 0.79 MPO (0.55) KDM4EMAPTKMT2ALMNASMN1; SMN2
SCHEMBL24029263 0.79 MPO (0.55) KDM4EMAPTKMT2ALMNASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160067257-A1 SCREENING METHOD AND COMPOUNDS FOR MODULATING TELOMERASE ACTIVITY THE WISTAR INSTITUTE (US) 2016-03-10 US disclosed
US-9234230-B2 Screening method and compounds for modulating telomerase activity THE WISTAR INSTITUTE (US) 2016-01-12 US disclosed
US-8518940-B2 FP-pocket-binding effectors and methods for using the same to modulate telomerase activity THE WISTAR INSTITUTE (US) 2013-08-27 US disclosed
US-20120309759-A1 Screening Method and Compounds for Modulating Telomerase Activity THE WISTAR INSTITUTE (US) 2012-12-06 US disclosed
US-20100158798-A1 FP-Pocket-Binding Effectors and Methods for Using the Same to Modulate Telomerase Activity THE WISTAR INSTITUTE 2010-06-24 US disclosed
US-20030176314-A1 Compounds for the treatment of pain H. LUNDBECK A/S (DK) 2003-09-18 US disclosed
US-20030139431-A1 Guanidines which are agonist/antagonist ligands for neuropeptide FF (NPFF) receptors H. LUNDBECK A/S (DK) 2003-07-24 US disclosed
WO-2003026657-A1 COMPOUNDS FOR THE TREATMENT OF PAIN SYNAPTIC PHARMACEUTICAL CORPORATION (US) 2003-04-03 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 (5 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-20120309759-A1 Screening Method and Compounds for Modulating Telomerase Activity TERT, TERB1, TERF2 KDM4E 2189/4885MAPT 2733/4885KMT2A 2921/4885
US-20030176314-A1 Compounds for the treatment of pain NPFFR2, NPFFR1, OPRL1 KDM4E 4560/4885MAPT 2186/4885KMT2A 2310/4885
US-20100158798-A1 FP-Pocket-Binding Effectors and Methods for Using the Same to Modulate Telomerase Activity TERF2IP, TERF2, TERT KDM4E 2087/4885MAPT 3047/4885KMT2A 2483/4885
US-20160067257-A1 SCREENING METHOD AND COMPOUNDS FOR MODULATING TELOMERASE ACTIVITY TERT, TERB1, TERF2 KDM4E 2189/4885MAPT 2733/4885KMT2A 2921/4885
US-20030139431-A1 Guanidines which are agonist/antagonist ligands for neuropeptide FF (NPFF) receptors NPFFR1, NPFFR2, SSTR3 KDM4E 3447/4885MAPT 4577/4885KMT2A 3563/4885

“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.