SCHEMBL23023733

SCHEMBL23023733

CCOC(=O)c1c(-c2ccccc2F)nc2ccc(Cl)nn12

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.51
NPSR1 Q6W5P4 2/20 0.51
HPGD P15428 1/20 0.51
HSD17B10 Q99714 1/20 0.51
CYP1A2 P05177 2/20 0.47
CYP2C9 P11712 2/20 0.47
CYP2C19 P33261 2/20 0.47
NPC1 O15118 3/20 0.43
RAB9A P51151 3/20 0.43
SMN1; SMN2 Q16637 2/20 0.42
JAK2 O60674 1/20 0.42
JAK3 P52333 1/20 0.42
MAPT P10636 2/20 0.41
ALOX5 P09917 3/20 0.41
MAPK1 P28482 1/20 0.40
GAA P10253 1/20 0.39
KDM4E B2RXH2 1/20 0.39
LMNA P02545 1/20 0.38
TSHR P16473 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
SCHEMBL23013130 0.89 ALDH1A1 (0.50) ALDH1A1NPSR1HPGDHSD17B10CYP1A2
SCHEMBL29703799 0.89 ALDH1A1 (0.50) ALDH1A1NPSR1HPGDHSD17B10CYP1A2
SCHEMBL23023704 0.86 CYP1A2 (0.40) ALDH1A1NPSR1HPGDHSD17B10CYP1A2
SCHEMBL23013498 0.84 ALDH1A1 (0.46) ALDH1A1NPSR1HPGDHSD17B10CYP1A2
SCHEMBL29692671 0.84 ALDH1A1 (0.46) ALDH1A1NPSR1HPGDHSD17B10CYP1A2
SCHEMBL25150438 0.84 CYP1A2 (0.65) ALDH1A1HPGDCYP1A2CYP2C9CYP2C19
SCHEMBL29692267 0.83 NPC1 (0.51) ALDH1A1NPSR1HPGDHSD17B10CYP1A2
SCHEMBL23013917 0.83 NPC1 (0.51) ALDH1A1NPSR1HPGDHSD17B10CYP1A2
SCHEMBL23013504 0.82 PDE4A (0.54) ALDH1A1NPSR1HPGDHSD17B10CYP1A2
SCHEMBL23013072 0.81 RXFP1 (0.45) ALDH1A1NPSR1HPGDHSD17B10NPC1

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
US-11634425-B2 Pharmaceutical compounds PFIZER INC. (US) 2023-04-25 US disclosed
WO-2021032992-A1 PHARMACEUTICAL COMPOUNDS ReViral Limited (GB) 2021-02-25 WO 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-11634425-B2 Pharmaceutical compounds GABRA6, CHRNA6, CNR1 ALDH1A1 3010/4885NPSR1 112/4885HPGD 3197/4885

“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.