SCHEMBL31414218

SCHEMBL31414218

C=C(C)C(=O)OC.C=CN1CCCCCC1=O

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.43
KMT2A Q03164 1/20 0.34
ATM Q13315 1/20 0.34
STAT6 P42226 1/20 0.32
TP53 P04637 1/20 0.32
MAPT P10636 1/20 0.32
HSD17B10 Q99714 1/20 0.32
MITF O75030 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL264350 0.94 ALDH1A1 (0.46) ALDH1A1KMT2AATMMAPT
Methacrylic Acid SCHEMBL9327599 0.90 ALDH1A1 (0.42) ALDH1A1KMT2AATMMAPT
SCHEMBL11131633 0.85 ALDH1A1 (0.38) ALDH1A1KMT2AATM
Methacrylic Acid SCHEMBL28636504 0.85 KMT2A (0.37) ALDH1A1KMT2AMAPTHSD17B10MITF
SCHEMBL29407115 0.84 ALDH1A1 (0.37) ALDH1A1KMT2AATM
SCHEMBL11210985 0.83 ALDH1A1 (0.36) ALDH1A1
SCHEMBL14973716 0.83 THRB (0.34) ALDH1A1KMT2AATM
SCHEMBL29430956 0.81 ALDH1A1 (0.34) ALDH1A1
SCHEMBL28346618 0.81 KMT2A (0.35) KMT2AATM
SCHEMBL6823753 0.81 ALDH1A1 (0.33) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3778792-B1 PHOTOCURABLE INK COMPOSITION AND IMAGE FORMING METHOD FUJIFILM CORP (JP) 2025-01-22 EP disclosed