SCHEMBL7792216

SCHEMBL7792216

CCN(CC)CCOc1cc(OC)c2c(c1N)C(=O)c1cccc(OCCN(CC)CC)c1-2

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.41
KMT2A Q03164 2/20 0.41
MAPT P10636 1/20 0.41
CHRNA7 P36544 1/20 0.41
MAOB P27338 1/20 0.41
ADORA2A P29274 2/20 0.40
ADORA1 P30542 2/20 0.40
EGFR P00533 1/20 0.39
PDGFRB P09619 1/20 0.39
FGFR1 P11362 1/20 0.39
KDR P35968 1/20 0.39
NOS3 P29474 1/20 0.39
NOS1 P29475 1/20 0.39
KDM4E B2RXH2 2/20 0.38
LMNA P02545 1/20 0.38
MEN1 O00255 1/20 0.38
HTR7 P34969 1/20 0.38
TSHR P16473 1/20 0.38
KCNA3 P22001 1/20 0.38
DRD2 P14416 1/20 0.38

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
Hydrochloric Acid SCHEMBL7794703 0.99 ALDH1A1 (0.41) ALDH1A1KMT2AMAPTCHRNA7MAOB
SCHEMBL7792098 0.98 ALDH1A1 (0.41) ALDH1A1KMT2AMAPTCHRNA7MAOB
SCHEMBL7791899 0.97 TTR (0.40) ALDH1A1KMT2AMAPTCHRNA7MAOB
SCHEMBL7792470 0.97 CYP1A2 (0.42) ALDH1A1KMT2AMAPTCHRNA7MAOB
Hydrochloric Acid SCHEMBL7786457 0.97 ALDH1A1 (0.41) ALDH1A1KMT2AMAPTCHRNA7MAOB
SCHEMBL7792112 0.94 ALDH1A1 (0.46) ALDH1A1KMT2AMAOBMEN1KCNA3
SCHEMBL27534207 0.93 CYP1A2 (0.39) ALDH1A1KMT2AMAPTCHRNA7MAOB
SCHEMBL7786466 0.93 CYP1A2 (0.42) ALDH1A1KMT2AMAPTCHRNA7MAOB
SCHEMBL7796236 0.93 TTR (0.40) ALDH1A1KMT2AMAPTCHRNA7MAOB
SCHEMBL7794813 0.92 ALDH1A1 (0.46) ALDH1A1KMT2AMAOBMEN1KCNA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0906268-B1 ALKYLOXYAMINO SUBSTITUTED FLUORENONES AND THEIR USE AS PROTEIN KINASE C INHIBITORS AVENTIS PHARMA INC (US) 2001-11-28 EP disclosed
US-6004959-A HYPOTENSIVE, ANTITUMOR, ANTIINFLAMMATORY AND ANTIASTHMATIC AGENTS; ANGIOGENESIS AND ALVEOLAR MACROPHAGE ACTIVATION INHIBITORS HOECHST MARION ROUSSEL, INC. (US) 1999-12-21 US disclosed