SCHEMBL6136846

SCHEMBL6136846

Oc1cccnc1Sc1ccccc1Br

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 2/20 0.42
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
PSMD14 O00487 1/20 0.39
NPC1 O15118 1/20 0.39
AGTR1 P30556 1/20 0.39
OPRK1 P41145 1/20 0.39
LMNA P02545 1/20 0.37
ALDH1A1 P00352 4/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
MMP2 P08253 1/20 0.36
CHRM1 P11229 1/20 0.36
TSHR P16473 1/20 0.36
COMT P21964 1/20 0.36
ADRA1A P35348 1/20 0.36
METAP2 P50579 1/20 0.36
METAP1 P53582 1/20 0.36
HDAC8 Q9BY41 1/20 0.36
LDHA P00338 1/20 0.35
PTPN11 Q06124 1/20 0.35

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
SCHEMBL28048983 0.79 HSD17B10 (0.46) PKMMEN1KMT2APSMD14NPC1
SCHEMBL6136756 0.76 SMN1; SMN2 (0.49) MEN1KMT2AALDH1A1L3MBTL1MMP2
SCHEMBL18612764 0.75 P2RY2 (0.48) PKMMEN1KMT2APSMD14NPC1
SCHEMBL18612763 0.74 MEN1 (0.56) PKMMEN1KMT2ALMNAALDH1A1
SCHEMBL6136859 0.73 ALDH1A1 (0.45) MEN1KMT2AALDH1A1L3MBTL1MMP2
SCHEMBL2099494 0.72 L3MBTL1 (0.46) MEN1KMT2ANPC1LMNAALDH1A1
SCHEMBL5116967 0.72 ALDH1A1 (0.51) MEN1KMT2ANPC1LMNAALDH1A1
SCHEMBL3282096 0.71 LMNA (0.57) MEN1KMT2ALMNAALDH1A1LDHA
SCHEMBL29543575 0.71 LMNA (0.57) MEN1KMT2ALMNAALDH1A1LDHA
SCHEMBL6136858 0.69 GRM5 (0.46) MEN1KMT2AALDH1A1MMP2CHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1120409-B1 2,3-DISUBSTITUTED PYRIDINE DERIVATIVES, PROCESS FOR THE PREPARATION THEREOF, DRUG COMPOSITIONS CONTAINING THE SAME AND INTERMEDIATES FOR THE PREPARATION DAINIPPON PHARMACEUTICAL CO (JP) 2005-01-26 EP disclosed
US-6765095-B2 HETEROCYCLIC IMINES SUCH AS 2-PHENOXY-3-(3-(PYRIDIN-4-YL)-PROPOXY)PYRIDINE, FORMED BY ETHERIFICATION, AMINATION OR SULIFIDING, FOR USE AS PHOSPHODIESTERASE INHIBITORS DAINIPPON PHARMACEUTICAL COMPANY, LIMITED (JP) 2004-07-20 US disclosed
US-6683186-B2 CONDENSATION, ETHERIFICATION; PHOSPHODIESTERASE INHIBITORS; ANTIALLERGENS, ANTIINFLAMMATORY AND ANTIASTHMATIC AGENTS DAINIPPON PHARMACEUTICAL COMPANY, LIMITED (JP) 2004-01-27 US disclosed
US-20030199554-A1 2,3-Disubstituted pyridine derivative, process for the preparation thereof, pharmaceutical composition containing the same, and intermediate therefor KAWASAKI MOTOJI (JP) 2003-10-23 US disclosed
US-20030195232-A1 2,3-Disubstituted pyridine derivative, process for the preparation thereof, pharmaceutical composition containing the same, and intermediate therefor KAWASAKI MOTOJI (JP) 2003-10-16 US disclosed
US-6555557-B1 2-(3-chlorophenoxy)-3-(3-(3-hydroxypyridin-5-yl)propoxy) -pyridine, for example; phosphodiesterase IV inhibitors DAINIPPON PHARMACEUTICAL COMPANY, LIMITED (JP) 2003-04-29 US disclosed
EP-1120409-A1 2,3-DISUBSTITUTED PYRIDINE DERIVATIVES, PROCESS FOR THE PREPARATION THEREOF, DRUG COMPOSITIONS CONTAINING THE SAME AND INTERMEDIATES FOR THE PREPARATION Dainippon Pharmaceutical Co., Ltd. (JP) 2001-08-01 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 (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-20030199554-A1 2,3-Disubstituted pyridine derivative, process for the preparation thereof, pharmaceutical composition containing the same, and intermediate therefor NOX1, CYP4A11, PDE12 PKM 3277/4885MEN1 3856/4885KMT2A 1966/4885
US-20030195232-A1 2,3-Disubstituted pyridine derivative, process for the preparation thereof, pharmaceutical composition containing the same, and intermediate therefor NOX1, CYP4A11, PDE12 PKM 3277/4885MEN1 3856/4885KMT2A 1966/4885

“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.