SCHEMBL9636375

SCHEMBL9636375

CCOCCn1c(CN2CCNCC2)nc2ccncc21

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.44
TSHR P16473 2/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
SLC6A9 P48067 1/20 0.41
PKM P14618 1/20 0.41
POLB P06746 1/20 0.40
HRH1 P35367 2/20 0.40
KDM4E B2RXH2 1/20 0.40
USP2 O75604 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
GRM2 Q14416 1/20 0.40
LMNA P02545 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40

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
Fumaric Acid SCHEMBL9635000 0.92 ALDH1A1 (0.40) ALDH1A1TSHRMEN1KMT2ASLC6A9
SCHEMBL9687118 0.91 MEN1 (0.42) ALDH1A1TSHRMEN1KMT2ASLC6A9
SCHEMBL6151147 0.85 MEN1 (0.58) ALDH1A1TSHRMEN1KMT2APOLB
SCHEMBL9635883 0.85 MEN1 (0.47) ALDH1A1TSHRMEN1KMT2ASLC6A9
Fumaric Acid SCHEMBL9636370 0.83 SLC6A9 (0.38) ALDH1A1TSHRMEN1KMT2ASLC6A9
SCHEMBL6586477 0.82 MEN1 (0.54) ALDH1A1TSHRMEN1KMT2AHRH1
SCHEMBL9634434 0.79 SLC6A9 (0.46) ALDH1A1TSHRMEN1KMT2ASLC6A9
SCHEMBL9635855 0.78 SLC6A9 (0.64) ALDH1A1TSHRMEN1KMT2ASLC6A9
Fumaric Acid SCHEMBL10499414 0.77 TSHR (0.51) ALDH1A1TSHRMEN1KMT2APOLB
Fumaric Acid SCHEMBL10499430 0.77 TSHR (0.51) ALDH1A1TSHRMEN1KMT2APOLB

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
EP-0307014-B1 ANTI-ALLERGIC 2-(HETEROCYCLYL ALKYL) IMIDAZO PYRIDINES AND 2-(HETEROCYCLYL ALKYL) PURINES JANSSEN PHARMACEUTICA N.V. (BE) 1992-12-09 EP disclosed
US-5086056-A Treating allergic diseases JANSSEN PHARMACEUTICA N.V. (BE) 1992-02-04 US disclosed
US-5011842-A Antihistamines JANSSEN PHARMACEUTICA N.V. (BE) 1991-04-30 US disclosed
US-4946843-A ANTIALLERGENS JANSSEN PHARMACEUTICA N.V. (BE) 1990-08-07 US disclosed
EP-0307014-A1 Anti-allergic 2-(heterocyclyl alkyl) imidazo pyridines and 2-(heterocyclyl alkyl) purines JANSSEN PHARMACEUTICA N.V. (BE) 1989-03-15 EP disclosed