SCHEMBL16504459

SCHEMBL16504459

CC(=O)Nc1ccc(O)c(-c2cc(NC(C)=O)ccc2O)c1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM5A P29375 1/20 0.59
KDM4D Q6B0I6 1/20 0.59
KDM4C Q9H3R0 1/20 0.59
KDM5B Q9UGL1 1/20 0.59
KDM3A Q9Y4C1 1/20 0.59
MEN1 O00255 4/20 0.58
MAPT P10636 4/20 0.58
KMT2A Q03164 4/20 0.58
ALDH1A1 P00352 3/20 0.58
SMN1; SMN2 Q16637 3/20 0.58
RAB9A P51151 3/20 0.58
NPC1 O15118 2/20 0.58
PKM P14618 1/20 0.58
MAOA P21397 1/20 0.58
CA12 O43570 2/20 0.57
CA1 P00915 2/20 0.57
CA2 P00918 2/20 0.57
CA9 Q16790 2/20 0.57
BRD4 O60885 1/20 0.57
NR1I2 O75469 1/20 0.57

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
SCHEMBL11168902 0.85 RAB9A (0.56) KDM5AKDM4DKDM4CKDM5BKDM3A
SCHEMBL3192352 0.85 PKM (0.65) MEN1MAPTKMT2AALDH1A1SMN1; SMN2
SCHEMBL16504728 0.84 ALDH1A1 (0.49) KDM5AKDM4DKDM4CKDM5BKDM3A
SCHEMBL11163471 0.83 SMN1; SMN2 (0.50) KDM5AKDM4DKDM4CKDM5BKDM3A
SCHEMBL13165575 0.83 ALDH1A1 (0.67) MEN1MAPTKMT2AALDH1A1SMN1; SMN2
SCHEMBL7547627 0.82 ALDH1A1 (0.59) MEN1MAPTKMT2AALDH1A1SMN1; SMN2
SCHEMBL11417747 0.82 SMN1; SMN2 (0.59) MEN1MAPTKMT2AALDH1A1SMN1; SMN2
SCHEMBL693623 0.80 PKM (0.54) MEN1MAPTKMT2AALDH1A1SMN1; SMN2
SCHEMBL4055616 0.80 TDP1 (0.57) MEN1MAPTKMT2AALDH1A1SMN1; SMN2
SCHEMBL22374212 0.80 PKM (0.54) MEN1MAPTKMT2AALDH1A1SMN1; SMN2

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-3368027-B1 METHODS OF TREATING PAIN OR FEVER USING PHARMACEUTICALLY ACTIVE ACETAMINOPHEN DIMERS LINKED THROUGH PHENOLIC HYDROXYL GROUPS ORPHOMED INC (US) 2022-03-02 EP disclosed
US-8071619-B2 Injectable liquid formulation of paracetamol NGUYEN-XUAN THO (CH) 2011-12-06 US disclosed