SCHEMBL9070477

SCHEMBL9070477

Cc1cc(NC2CCCC2)c2c(ccc3cn[nH]c32)n1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.45
▸ ALDH1A1 P00352 2/20 0.45
▸ MAPT P10636 2/20 0.45
▸ MEN1 O00255 2/20 0.45
▸ KMT2A Q03164 2/20 0.45
▸ APAF1 O14727 1/20 0.45
▸ MAPK1 P28482 1/20 0.45
▸ BLM P54132 1/20 0.45
▸ HSD17B10 Q99714 1/20 0.45
▸ TDP1 Q9NUW8 1/20 0.45
▸ LRRK2 Q5S007 3/20 0.41
▸ CDK1 P06493 2/20 0.38
▸ CDK4 P11802 2/20 0.38
▸ CCNB1 P14635 2/20 0.38
▸ CCNA2 P20248 2/20 0.38
▸ CCND1 P24385 2/20 0.38
▸ CDK2 P24941 2/20 0.38
▸ CCNA1 P78396 2/20 0.38
▸ SLC2A1 P11166 1/20 0.38
▸ ADORA2A P29274 1/20 0.37

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
SCHEMBL9069463 0.99 KDM4E (0.47) KDM4EALDH1A1MAPTMEN1KMT2A
Hydrochloric Acid SCHEMBL9073160 0.98 KDM4E (0.46) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL9069462 0.93 KDM4E (0.40) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL9376581 0.84 KDM4E (0.44) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL10805916 0.81 SLC2A1 (0.47) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL9370791 0.79 MEN1 (0.46) KDM4EALDH1A1MAPTMEN1KMT2A
Hydrochloric Acid SCHEMBL11846718 0.77 IP6K1 (0.44) ALDH1A1HSD17B10LRRK2ADORA2AADORA1
SCHEMBL9073073 0.76 PTGS1 (0.43) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL9069382 0.75 PTGS1 (0.43) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL9073452 0.75 L3MBTL1 (0.53) KDM4EALDH1A1MAPTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5506235-A Quinoline derivatives as immunostimulants PFIZER INC. (US) 1996-04-09 — — US disclosed
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