SCHEMBL7733875

SCHEMBL7733875

OCCCc1cc(Cl)cc2nc(Cc3ccccc3)oc12

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.41
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
ELANE P08246 1/20 0.40
MAPT P10636 3/20 0.39
TP53 P04637 2/20 0.39
MTNR1A P48039 5/20 0.38
MTNR1B P49286 5/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
EGFR P00533 1/20 0.37
CYP3A4 P08684 1/20 0.37
HPGD P15428 1/20 0.37
ALOX15 P16050 1/20 0.37
HIF1A Q16665 1/20 0.37
HSD17B10 Q99714 1/20 0.37
POLB P06746 1/20 0.36
AKR1B1 P15121 1/20 0.36
SIRT2 Q8IXJ6 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
SCHEMBL7735795 0.91 MAPT (0.45) LMNAMEN1KMT2AMAPTTP53
SCHEMBL7735662 0.91 NPC1 (0.42) LMNAMEN1KMT2AMAPTTP53
SCHEMBL7734337 0.87 NLRP3 (0.36) LMNAMAPTMTNR1AMTNR1BAKR1B1
SCHEMBL7734231 0.85 RAB9A (0.40) KMT2AHPGDPOLBSIRT2
SCHEMBL7734855 0.84 SIRT2 (0.34) MEN1KMT2AMTNR1AMTNR1BAKR1B1
SCHEMBL7734700 0.82 NLRP3 (0.35) LMNAMAPTMTNR1AMTNR1BAKR1B1
SCHEMBL7734093 0.82 SIRT2 (0.37) MEN1KMT2AMAPTMTNR1AMTNR1B
SCHEMBL7734848 0.82 MAPT (0.38) MEN1KMT2AMAPTSMN1; SMN2CYP3A4
SCHEMBL7734102 0.81 TSHR (0.43) LMNAMEN1KMT2AMAPTSMN1; SMN2
SCHEMBL7735189 0.80 GAA (0.36) MEN1KMT2AMAPTSMN1; SMN2POLB

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
US-6372770-B1 TREATING A MAMMAL SUFFERING FROM A DISEASE STATE SELECTED FROM THE GROUP CONSISTING OF ASTHMA, ALLERGIES, INFLAMMATION, DEPRESSION, DEMENTIA, ATOPIC DISEASES, RHINITIS AND DISEASE STATES ASSOCIATED WITH ABNORMALLY HIGH PHYSIOLOGICAL LEVELS OF EURO-CELTIQUE, S.A. 2002-04-16 US claimed
US-6372770-B1 TREATING A MAMMAL SUFFERING FROM A DISEASE STATE SELECTED FROM THE GROUP CONSISTING OF ASTHMA, ALLERGIES, INFLAMMATION, DEPRESSION, DEMENTIA, ATOPIC DISEASES, RHINITIS AND DISEASE STATES ASSOCIATED WITH ABNORMALLY HIGH PHYSIOLOGICAL LEVELS OF EURO-CELTIQUE, S.A. 2002-04-16 US disclosed