SCHEMBL10987489

SCHEMBL10987489

Cc1ccccc1-c1ccc(Cl)nn1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 4/20 0.50
MEN1 O00255 2/20 0.49
HTT P42858 2/20 0.49
KMT2A Q03164 2/20 0.49
CNR2 P34972 1/20 0.47
IDO1 P14902 1/20 0.47
METAP2 P50579 1/20 0.47
LMNA P02545 4/20 0.46
NPC1 O15118 4/20 0.46
RAB9A P51151 4/20 0.46
ALDH1A1 P00352 4/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
MAPT P10636 3/20 0.46
KDM4E B2RXH2 3/20 0.46
HPGD P15428 2/20 0.46
APAF1 O14727 1/20 0.46
TDP2 O95551 1/20 0.46
PKM P14618 1/20 0.46
CASP3 P42574 1/20 0.44
SENP8 Q96LD8 1/20 0.44

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
SCHEMBL10840406 0.79 IDO1 (0.52) MAOBMEN1HTTKMT2ACNR2
SCHEMBL24148855 0.79 CNR2 (0.50) MAOBMEN1HTTKMT2ACNR2
SCHEMBL2014264 0.78 LMNA (0.51) MAOBMEN1HTTKMT2ALMNA
SCHEMBL20405382 0.78 RAB9A (0.52) MAOBMEN1HTTKMT2ACNR2
SCHEMBL5502067 0.77 MAOB (0.52) MAOBMEN1HTTKMT2ALMNA
SCHEMBL11627415 0.77 IDO1 (0.56) MAOBMEN1HTTKMT2ACNR2
SCHEMBL4786510 0.76 ALDH1A1 (0.52) MAOBMEN1HTTKMT2AIDO1
SCHEMBL16835822 0.76 CNR2 (0.47) MAOBMEN1HTTKMT2ACNR2
SCHEMBL10973695 0.76 KMT2A (0.49) MAOBMEN1HTTKMT2AIDO1
SCHEMBL4023321 0.76 MEN1 (0.49) MEN1HTTKMT2AIDO1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021260609-A1 PROCESS FOR THE MANUFACTURE OF 1,4-DISUBSTITUTED PYRIDAZINE COMPOUNDS NOVARTIS AG (CH) 2021-12-30 WO disclosed
US-20180186801-A1 SUBSTITUTED BICYCLIC AZA-HETEROCYCLES AND ANALOGUES AS SIRTUIN MODULATORS GLAXOSMITHKLINE LLC 2018-07-05 US disclosed
US-9957271-B2 Substituted bicyclic aza-heterocycles and analogues as sirtuin modulators GLAXOSMITHKLINE LLC (US) 2018-05-01 US disclosed
US-20140349993-A1 SUBSTITUTED BICYCLIC AZA-HETEROCYCLES AND ANALOGUES AS SIRTUIN MODULATORS GLAXOSMITHKLINE LLC 2014-11-27 US disclosed
US-4503056-A ANTIINFLAMMATORY AGENTS ABBOTT LABORATORIES (US) 1985-03-05 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 (2 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-20140349993-A1 SUBSTITUTED BICYCLIC AZA-HETEROCYCLES AND ANALOGUES AS SIRTUIN MODULATORS SIRT1, SIRT3, SIRT2 MAOB 286/4885MEN1 4061/4885HTT 223/4885
US-20180186801-A1 SUBSTITUTED BICYCLIC AZA-HETEROCYCLES AND ANALOGUES AS SIRTUIN MODULATORS SIRT1, SIRT3, SIRT2 MAOB 286/4885MEN1 4061/4885HTT 223/4885

“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.