SCHEMBL11408024

SCHEMBL11408024

C=CCNc1ccc2c(c1)C(=O)OC2=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA9 Q16790 1/20 0.44
ALDH1A1 P00352 3/20 0.41
KMT2A Q03164 3/20 0.40
CASP3 P42574 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
MITF O75030 1/20 0.40
NSD2 O96028 1/20 0.40
LMNA P02545 1/20 0.40
HTT P42858 1/20 0.40
SENP8 Q96LD8 1/20 0.40
SENP7 Q9BQF6 1/20 0.40
SENP6 Q9GZR1 1/20 0.40
ALOX15 P16050 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
DHFR P00374 2/20 0.37
MAPT P10636 3/20 0.35
MCL1 Q07820 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
SCHEMBL2537623 0.80 ALDH1A1 (0.54) CA12CA1CA2CA9ALDH1A1
SCHEMBL11045211 0.80 CASP3 (0.53) CA12CA1CA2CA9ALDH1A1
SCHEMBL13759609 0.75 ALDH1A1 (0.49) CA12CA1CA2CA9ALDH1A1
SCHEMBL15452134 0.74 ALOX15 (0.50) CA12CA1CA2CA9ALDH1A1
Phthalic Anhydride SCHEMBL11328910 0.73 TDP1 (0.56) ALDH1A1KMT2ACASP3L3MBTL1MITF
SCHEMBL11567742 0.72 APP (0.49) CA12CA1ALDH1A1KMT2AL3MBTL1
SCHEMBL15452133 0.72 APP (0.49) CA12CA1ALDH1A1KMT2AL3MBTL1
SCHEMBL27531251 0.72 ALOX15 (0.48) CA12CA1ALDH1A1KMT2AALOX15
SCHEMBL17481245 0.72 FTO (0.52) ALDH1A1LMNAMAPTKDM4E
SCHEMBL27371589 0.72 AR (0.46) ALDH1A1KMT2AL3MBTL1HTTALOX15

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-4261898-A ADHESION PROMOTERS, CURING AGENTS CIBA-GEIGY CORPORATION (US) 1981-04-14 US disclosed
US-4176124-A ADHESION PROMOTERS BETWEEN SOLIDS AND ORGANIC RESINS OR CURING AGENTS FOR EPOXIDE RESINS CIBA-GEIGY CORPORATION (US) 1979-11-27 US disclosed