SCHEMBL191691

SCHEMBL191691

c1ccc(Sc2ncnc3[nH]ccc23)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC7 O00311 2/20 0.61
DBF4 Q9UBU7 2/20 0.61
JAK2 O60674 3/20 0.54
NOTUM Q6P988 1/20 0.54
TTBK1 Q5TCY1 7/20 0.51
TTBK2 Q6IQ55 7/20 0.51
TRPA1 O75762 1/20 0.50
CSF1R P07333 3/20 0.44
LMNA P02545 2/20 0.44
MAPT P10636 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
NPC1 O15118 1/20 0.44
ALDH1A1 P00352 1/20 0.44
HPGD P15428 1/20 0.44
RAB9A P51151 1/20 0.44
JAK3 P52333 3/20 0.42
DAPK3 O43293 2/20 0.42
PRKD3 O94806 2/20 0.42
MAP4K4 O95819 2/20 0.42
PAK4 O96013 2/20 0.42

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
SCHEMBL6661474 0.84 TRPA1 (0.52) CDC7DBF4JAK2NOTUMTTBK1
SCHEMBL26784728 0.84 TTBK1 (0.49) CDC7DBF4JAK2NOTUMTTBK1
SCHEMBL26786653 0.80 TTBK1 (0.57) CDC7DBF4NOTUMTTBK1TTBK2
SCHEMBL6273375 0.78 TTBK1 (0.52) CDC7DBF4JAK2NOTUMTTBK1
SCHEMBL192920 0.76 CDC7 (1.00) CDC7DBF4JAK2NOTUMTTBK1
SCHEMBL21218365 0.74 TTBK1 (0.60) CDC7DBF4JAK2TTBK1TTBK2
SCHEMBL796397 0.73 LMNA (0.44) CDC7DBF4JAK2NOTUMLMNA
SCHEMBL5244234 0.72 LMNA (0.56) LMNAMAPTSMN1; SMN2NPC1ALDH1A1
SCHEMBL27212829 0.72 KDM1A (0.58) LMNAMAPTSMN1; SMN2NPC1ALDH1A1
SCHEMBL17954541 0.71 CDC7 (0.63) CDC7DBF4JAK2NOTUMTTBK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4662319-A2 PERSONALIZED CRISPR PROFILING FOR CANCER Integrate Bioscience LLC (US) 2025-12-17 EP disclosed
WO-2024168301-A2 PERSONALIZED CRISPR PROFILING FOR CANCER FUNCTION ONCOLOGY, INC. (US) 2024-08-15 WO disclosed
US-20190255052-A1 Inhibitors of E1 Activating Enzymes MILLENNIUM PHARMACEUTICALS, INC. (US) 2019-08-22 US disclosed
CN-110003216-A E1 activating enzyme inhibitors 千禧药品公司 2019-07-12 CN disclosed
CN-106008512-B E1 activating enzyme inhibitors 千禧药品公司 2019-03-12 CN disclosed
US-20170136024-A1 INHIBITORS OF E1 ACTIVATING ENZYMES MILLENNIUM PHARMACEUTICALS, INC. 2017-05-18 US disclosed
CN-106008512-A INHIBITORS OF E1 ACTIVATING ENZYMES 千禧药品公司 2016-10-12 CN disclosed
EP-2402334-B1 Inhibitors of E1 Activating Enzymes MILLENNIUM PHARM INC (US) 2016-06-29 EP disclosed
CN-101379061-B E1 activating enzyme inhibitor 千禧药品公司 2016-06-15 CN disclosed
US-20130289037-A1 INHIBITORS OF E1 ACTIVTING ENZYMES MILLENNIUM PHARM INC (US) 2013-10-31 US disclosed
US-20130165457-A9 INHIBITORS OF E1 ACTIVATING ENZYMES MILLENNIUM PHARMACEUTICALS, INC. (US) 2013-06-27 US disclosed
US-20120258977-A1 INHIBITORS OF E1 ACTIVATING ENZYMES MILLENNIUM PHARMACEUTICALS, INC. (US) 2012-10-11 US disclosed
US-20120258927-A1 INHIBITORS OF E1 ACTIVATING ENZYMES MILLENIUM PHARMACEUTICALS, INC. (US) 2012-10-11 US disclosed
EP-1989206-B1 INHIBITORS OF E1 ACTIVATING ENZYME MILLENNIUM PHARM INC (US) 2012-07-04 EP disclosed
US-8207177-B2 Inhibitors of E1 activating enzymes MILLENNIUM PHARMACEUTICALS, INC. (US) 2012-06-26 US disclosed
EP-2402334-A1 Inhibitors of E1 Activating Enzymes Millennium Pharmaceuticals, Inc. (US) 2012-01-04 EP disclosed
US-20070191293-A1 Inhibitors of E1 activating enzymes MILLENNIUM PHARMACEUTICALS, INC. (US) 2007-08-16 US disclosed
EP-1444982-A1 The use of purine derivatives as selective kinase inhibitors MERCKLE GMBH (DE) 2004-08-11 EP 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 (7 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-20120258977-A1 INHIBITORS OF E1 ACTIVATING ENZYMES ECE1, RNASE1, RCE1 CDC7 342/4885DBF4 3600/4885JAK2 3421/4885
US-20120258927-A1 INHIBITORS OF E1 ACTIVATING ENZYMES ECE1, RNASE1, RCE1 CDC7 342/4885DBF4 3600/4885JAK2 3421/4885
US-20170136024-A1 INHIBITORS OF E1 ACTIVATING ENZYMES ECE1, RNASE1, RCE1 CDC7 342/4885DBF4 3600/4885JAK2 3421/4885
US-20190255052-A1 Inhibitors of E1 Activating Enzymes ECE1, RNASE1, RCE1 CDC7 342/4885DBF4 3600/4885JAK2 3421/4885
US-20130165457-A9 INHIBITORS OF E1 ACTIVATING ENZYMES ECE1, RNASE1, RCE1 CDC7 342/4885DBF4 3600/4885JAK2 3421/4885
US-20130289037-A1 INHIBITORS OF E1 ACTIVTING ENZYMES RNASE1, ECE1, CES1 CDC7 304/4885DBF4 3355/4885JAK2 3623/4885
US-20070191293-A1 Inhibitors of E1 activating enzymes ECE1, RNASE1, RCE1 CDC7 342/4885DBF4 3600/4885JAK2 3421/4885

“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.