SCHEMBL11078064

SCHEMBL11078064

O=C(O)C=CC(=O)NCCCNC(=O)C=CC(=O)O

nearest known ligand 0.63

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.63
TAAR1 Q96RJ0 6/20 0.61
KMT2A Q03164 1/20 0.52
LMNA P02545 2/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C19 P33261 1/20 0.48
TSHR P16473 2/20 0.45
TP53 P04637 1/20 0.45
EGLN1 Q9GZT9 1/20 0.45
EGLN3 Q9H6Z9 1/20 0.45
MAPT P10636 1/20 0.43
GAA P10253 1/20 0.43

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
SCHEMBL10979950 1.00 ALDH1A1 (0.63) ALDH1A1TAAR1KMT2ALMNACYP2D6
SCHEMBL11133921 0.95 ALDH1A1 (0.63) ALDH1A1TAAR1KMT2ALMNACYP2D6
SCHEMBL11133917 0.95 ALDH1A1 (0.63) ALDH1A1TAAR1KMT2ALMNACYP2D6
SCHEMBL11139011 0.93 ALDH1A1 (0.61) ALDH1A1TAAR1KMT2ALMNACYP2D6
SCHEMBL11140506 0.93 ALDH1A1 (0.61) ALDH1A1TAAR1KMT2ALMNACYP2D6
SCHEMBL11142756 0.93 ALDH1A1 (0.61) ALDH1A1TAAR1KMT2ALMNACYP2D6
SCHEMBL8857549 0.93 ALDH1A1 (0.61) ALDH1A1TAAR1KMT2ALMNACYP2D6
SCHEMBL11140662 0.93 ALDH1A1 (0.61) ALDH1A1TAAR1KMT2ALMNACYP2D6
SCHEMBL11140508 0.93 ALDH1A1 (0.61) ALDH1A1TAAR1KMT2ALMNACYP2D6
SCHEMBL11142483 0.93 ALDH1A1 (0.61) ALDH1A1TAAR1KMT2ALMNACYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4426469-A Glass fibers for the reinforcement of polyolefins and reinforced polyolefin compositions obtained therefrom MONTEDISON S.P.A. (IT) 1984-01-17 US disclosed
US-4374956-A METAL ADHESIVES MONSANTO COMPANY (US) 1983-02-22 US disclosed
US-4350797-A Process for promoting the adhesion of polyolefins to metals, glass sheets, cement, asbestos or polar polymers MONTEDISON S.P.A. (IT) 1982-09-21 US disclosed
US-4350740-A SUBSTITUTED MALEAMIC ACID MODIFIER; ADHESION TO METALS MONSANTO COMPANY (US) 1982-09-21 US disclosed
US-4278586-A BIS-MALEAMIC ACID MONTEDISON S.P.A. (IT) 1981-07-14 US disclosed