SCHEMBL7792434

SCHEMBL7792434

CCCCOc1cc(OC)cc2c1-c1c(OCCN(CC)CC)cccc1C2=O

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.51
CHRNA7 P36544 1/20 0.51
KMT2A Q03164 1/20 0.51
PTPN1 P18031 2/20 0.45
ELANE P08246 2/20 0.43
HTR1D P28221 1/20 0.42
HTR1B P28222 1/20 0.42
ESR1 P03372 1/20 0.42
KDR P35968 1/20 0.42
KCNA3 P22001 1/20 0.42
ALDH1A1 P00352 1/20 0.41

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
SCHEMBL8381770 0.95 MAPT (0.46) MAPTCHRNA7KMT2APTPN1ELANE
SCHEMBL7796371 0.94 MAPT (0.49) MAPTCHRNA7KMT2APTPN1ESR1
SCHEMBL7786494 0.93 MAPT (0.56) MAPTCHRNA7KMT2AELANEHTR1D
SCHEMBL7786378 0.92 KMT2A (0.49) MAPTCHRNA7KMT2APTPN1ESR1
SCHEMBL7796335 0.92 KMT2A (0.51) MAPTCHRNA7KMT2APTPN1ELANE
SCHEMBL7791978 0.91 MAPT (0.51) MAPTCHRNA7KMT2AELANEHTR1D
SCHEMBL7792157 0.91 MAPT (0.54) MAPTCHRNA7KMT2AELANEHTR1D
SCHEMBL8382358 0.89 MAPT (0.47) MAPTCHRNA7KMT2APTPN1ELANE
SCHEMBL7786093 0.89 MAPT (0.50) MAPTCHRNA7KMT2APTPN1ELANE
SCHEMBL7792642 0.89 ALDH1A1 (0.48) MAPTCHRNA7KMT2APTPN1ELANE

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