SCHEMBL22004332

SCHEMBL22004332

Cc1cc2cc(Cl)c(O)cc2n1C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACLY P53396 3/20 0.47
GPR35 Q9HC97 1/20 0.41
HPGD P15428 6/20 0.38
HSD17B10 Q99714 3/20 0.38
TSHR P16473 2/20 0.38
MEN1 O00255 6/20 0.36
KMT2A Q03164 6/20 0.36
MAPT P10636 3/20 0.36
PABPC1 P11940 1/20 0.36
S100A4 P26447 1/20 0.36
EIF4H Q15056 1/20 0.36
KDM4E B2RXH2 5/20 0.36
TDP1 Q9NUW8 3/20 0.36
ALOX15 P16050 4/20 0.33
ALDH1A1 P00352 3/20 0.33
CYP1A2 P05177 3/20 0.33
CYP3A4 P08684 3/20 0.33
CYP2C19 P33261 3/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33

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
SCHEMBL8944546 0.84 GPR35 (0.55) GPR35HPGDHSD17B10TSHRMEN1
SCHEMBL11719401 0.84 MEN1 (0.40) HPGDHSD17B10TSHRMEN1KMT2A
SCHEMBL22004331 0.77 ACLY (0.47) ACLYHPGDHSD17B10TSHRMEN1
SCHEMBL17427791 0.76 MEN1 (0.42) HPGDHSD17B10TSHRMEN1KMT2A
SCHEMBL22003821 0.75 ACLY (0.51) ACLYGPR35TSHRMEN1KMT2A
SCHEMBL8349495 0.73 GPR35 (0.41) GPR35HPGDHSD17B10TSHRMEN1
SCHEMBL22004321 0.72 HPGD (0.41) ACLYHPGDMEN1KMT2AMAPT
SCHEMBL31178596 0.70 FGFR1 (0.40) ACLYGPR35HPGDHSD17B10TSHR
SCHEMBL862785 0.70 ALDH1A1 (0.39) HPGDHSD17B10TSHRMEN1KMT2A
SCHEMBL27740167 0.69 GPR35 (0.38) GPR35HPGDHSD17B10TSHRMEN1

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-20200157076-A1 ACLY INHIBITORS AND USES THEREOF NIMBUS DISCOVERY, INC. 2020-05-21 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-20200157076-A1 ACLY INHIBITORS AND USES THEREOF ACLY, ATP5ME, ATP5MG ACLY 1/4885GPR35 3726/4885HPGD 1212/4885

“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.