SCHEMBL1678795

SCHEMBL1678795

Clc1cncc(NCc2cccnc2)n1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.53
CYP1A2 P05177 4/20 0.52
CYP2D6 P10635 3/20 0.52
CYP3A4 P08684 3/20 0.52
CYP2C19 P33261 2/20 0.52
CLK4 Q9HAZ1 2/20 0.52
ALOX15 P16050 1/20 0.52
POLB P06746 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
KMT2A Q03164 3/20 0.51
MEN1 O00255 2/20 0.51
PKM P14618 1/20 0.51
RAD52 P43351 1/20 0.51
ALDH1A1 P00352 3/20 0.49
HSD17B10 Q99714 2/20 0.49
LMNA P02545 1/20 0.48
TSHR P16473 1/20 0.48
APAF1 O14727 1/20 0.48
HK1 P19367 1/20 0.48
RAB9A P51151 1/20 0.48

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
SCHEMBL3143358 0.85 CDK2 (0.57) CYP1A2CYP2D6CYP3A4CYP2C19KMT2A
SCHEMBL13101037 0.81 MEN1 (0.58) LTA4HCYP1A2CYP2D6CYP3A4CYP2C19
SCHEMBL22792284 0.81 LTA4H (0.53) LTA4HCYP1A2CYP2D6CYP3A4CYP2C19
SCHEMBL22792060 0.81 LTA4H (0.53) LTA4HCYP1A2CYP2D6CYP3A4CYP2C19
SCHEMBL22792621 0.81 CYP1A2 (0.54) LTA4HCYP1A2CYP2D6CYP3A4CYP2C19
SCHEMBL6283187 0.80 MAP4K4 (0.48) KMT2AMEN1
SCHEMBL22792331 0.79 CYP1A2 (0.50) LTA4HCYP1A2CYP2D6CYP3A4CYP2C19
SCHEMBL3552220 0.79 KMT2A (0.56) LTA4HCYP1A2CYP2D6CYP3A4CYP2C19
SCHEMBL22792252 0.79 POLB (0.52) LTA4HCYP1A2CYP2D6CYP3A4CYP2C19
SCHEMBL22792616 0.78 MEN1 (0.51) LTA4HCYP1A2CYP2D6CYP3A4CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020252229-A2 INHIBITORS OF SARM1 DISARM THERAPEUTICS, INC. (US) 2020-12-17 WO disclosed
US-8329737-B2 Benzimidazoles as selective kinase inhibitors YM BIOSCIENCES AUSTRALIA PTY LTD (AU) 2012-12-11 US disclosed
US-8329737-B2 Benzimidazoles as selective kinase inhibitors YM BIOSCIENCES AUSTRALIA PTY LTD (AU) 2012-12-11 US disclosed
EP-1704145-B1 SELECTIVE KINASE INHIBITORS YM BIOSCIENCES AUSTRALIA PTY (AU) 2012-06-13 EP disclosed
US-20110082142-A1 SELECTIVE KINASE INHIBITORS CYTOPIA RESEARCH PTY LTD (AU) 2011-04-07 US disclosed
US-20110082142-A1 SELECTIVE KINASE INHIBITORS CYTOPIA RESEARCH PTY LTD (AU) 2011-04-07 US disclosed
CN-100558715-C Kinases inhibitor CYTOPIA PTY LTD (AU) 2009-11-11 CN disclosed
CN-100465173-C Selective kinase inhibitors CYTOPIA RES PTY LTD (AU) 2009-03-04 CN disclosed
US-20080207613-A1 Selective Kinase Inhibitors CYTOPIA RESEARCH PTY LTD (AU) 2008-08-28 US disclosed
US-20080207613-A1 Selective Kinase Inhibitors CYTOPIA RESEARCH PTY LTD (AU) 2008-08-28 US disclosed
EP-1513821-B1 PROTEIN KINASE INHIBITORS CYTOPIA PTY LTD (AU) 2007-10-31 EP disclosed
EP-1513821-B1 PROTEIN KINASE INHIBITORS CYTOPIA PTY LTD (AU) 2007-10-31 EP disclosed
CN-1906190-A Selective kinase inhibitors CYTOPIA RES PTY LTD (AU) 2007-01-31 CN disclosed
US-7122550-B2 Protein kinase inhibitors CYTOPIA PTY LTD (AU) 2006-10-17 US disclosed
US-20060148824-A1 Protein kinase inhibitors CYTOPIA RESEARCH PTY LTD (AU) 2006-07-06 US disclosed
EP-1513821-A4 PROTEIN KINASE INHIBITORS CYTOPIA PTY LTD (AU) 2006-05-03 EP disclosed
CN-1656082-A Protein kinase inhibitors CYTOPIA PTY LTD (AU) 2005-08-17 CN disclosed
EP-1513821-A1 PROTEIN KINASE INHIBITORS Cytopia PTY Ltd (AU) 2005-03-16 EP disclosed
US-20040235862-A1 For therapy of atopy, a cell mediated hypersensitivity, a rheumatic disease, an autoimmune disease, a viral disease, and a cancer YM BIOSCIENCES AUSTRALIA PTY LTD (AU) 2004-11-25 US disclosed
WO-2003099796-A1 PROTEIN KINASE INHIBITORS CYTOPIA PTY LTD (AU) 2003-12-04 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 (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-20040235862-A1 For therapy of atopy, a cell mediated hypersensitivity, a rheumatic disease, an autoimmune disease, a viral disease, and a cancer LCK, IRAK1, MAP2K5 LTA4H 344/4885CYP1A2 1752/4885CYP2D6 1556/4885
US-20110082142-A1 SELECTIVE KINASE INHIBITORS LCK, CHUK, CSK LTA4H 2523/4885CYP1A2 2072/4885CYP2D6 828/4885
US-20060148824-A1 Protein kinase inhibitors MAP3K20, MAP4K2, MAP3K1 LTA4H 4578/4885CYP1A2 2405/4885CYP2D6 1992/4885
US-20080207613-A1 Selective Kinase Inhibitors LCK, CHUK, CSK LTA4H 2523/4885CYP1A2 2072/4885CYP2D6 828/4885

“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.