SCHEMBL22166256

SCHEMBL22166256

Nc1ccc2c(c1)C(CO)c1cccc(C(=O)O)c1-2

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.38
MAPT P10636 4/20 0.38
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
THRB P10828 2/20 0.38
RECQL P46063 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
KDM4E B2RXH2 2/20 0.38
CYP3A4 P08684 2/20 0.38
POLB P06746 2/20 0.38
MCL1 Q07820 2/20 0.38
CASP7 P55210 2/20 0.38
CYP2C9 P11712 2/20 0.38
HPGD P15428 2/20 0.38
GAA P10253 2/20 0.38
USP2 O75604 1/20 0.38
PKM P14618 1/20 0.38
APEX1 P27695 1/20 0.38
BLM P54132 1/20 0.38
TNF P01375 1/20 0.38

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
SCHEMBL8092638 0.82 HNF4A (0.50) ALDH1A1MAPTMEN1KMT2AKDM4E
SCHEMBL1115139 0.77 CYP1A2 (0.43) ALDH1A1MAPTKMT2ACYP2C19HIF1A
SCHEMBL29844508 0.77 CDK5 (0.37) ALDH1A1MAPTMEN1KMT2ATDP1
SCHEMBL29844446 0.77 CDK5 (0.37) ALDH1A1MAPTMEN1KMT2ATDP1
SCHEMBL275596 0.77 CDK5 (0.37) ALDH1A1MAPTMEN1KMT2ATDP1
SCHEMBL1230997 0.76 HTR2A (0.47) ALDH1A1MAPTMEN1KMT2ATDP1
SCHEMBL29844647 0.76 HTR2A (0.47) ALDH1A1MAPTMEN1KMT2ATDP1
Hydrochloric Acid SCHEMBL27734241 0.75 CDK5 (0.36) ALDH1A1MAPTMEN1KMT2ATHRB
Hydrochloric Acid SCHEMBL1114916 0.75 CDK5 (0.36) ALDH1A1MAPTMEN1KMT2ATHRB
SCHEMBL12009206 0.74 MEN1 (0.47) ALDH1A1MAPTMEN1KMT2ATDP1

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
US-10695435-B2 Composition comprising a polymeric reagent NEKTAR THERAPEUTICS (US) 2020-06-30 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10695435-B2 Composition comprising a polymeric reagent CD44, FCGRT, C9 ALDH1A1 898/4885MAPT 1479/4885MEN1 1745/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.