SCHEMBL23328877

SCHEMBL23328877

CCc1ccc(-c2nc(C)cs2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.60
NPC1 O15118 5/20 0.60
GAA P10253 2/20 0.60
POLB P06746 1/20 0.60
CYP2E1 P05181 1/20 0.50
CYP3A4 P08684 1/20 0.50
CYP2A6 P11509 1/20 0.50
CYP2C9 P11712 1/20 0.50
CYP2B6 P20813 1/20 0.50
ADORA2A P29274 1/20 0.46
ADORA1 P30542 1/20 0.46
AOC3 Q16853 2/20 0.46
TLR7 Q9NYK1 1/20 0.46
SMN1; SMN2 Q16637 4/20 0.45
MEN1 O00255 1/20 0.43
LMNA P02545 1/20 0.43
HPGD P15428 1/20 0.43
KMT2A Q03164 1/20 0.43
PDE10A Q9Y233 1/20 0.43
SREBF2 Q12772 2/20 0.42

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
SCHEMBL8198560 0.88 CYP3A4 (0.60) RAB9ANPC1GAAPOLBCYP2E1
SCHEMBL7905176 0.86 CYP3A4 (0.58) RAB9ANPC1GAAPOLBCYP2E1
SCHEMBL21873479 0.83 RAB9A (0.54) RAB9ANPC1GAAPOLBCYP2E1
SCHEMBL8021391 0.83 CYP3A4 (0.49) RAB9ANPC1GAAPOLBCYP2E1
SCHEMBL12180534 0.82 RAB9A (0.59) RAB9ANPC1GAAPOLBCYP2E1
SCHEMBL18725058 0.80 CYP3A4 (0.53) RAB9ANPC1GAAPOLBCYP2E1
SCHEMBL13622940 0.79 RAB9A (0.58) RAB9ANPC1GAAPOLBTLR7
SCHEMBL14438067 0.78 CYP3A4 (0.61) RAB9ANPC1GAAPOLBCYP2E1
SCHEMBL2092693 0.78 KDM4E (0.56) RAB9ANPC1CYP2E1CYP3A4CYP2A6
SCHEMBL23367838 0.78 RAB9A (0.56) RAB9ANPC1GAACYP2E1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11806335-B2 Heterocyclic carboxylate compounds as glycolate oxidase inhibitors Lilac Therapeutics, Inc. (US) 2023-11-07 US disclosed
US-20230242535-A1 IMIDAZOTHIADIAZOLE AND IMIDAZOPYRAZINE DERIVATIVES AS PROTEASE ACTIVATED RECEPTOR 4 (PAR4) INHIBITORS FOR TREATING PLATELET AGGREGATION BRISTOL MYERS SQUIBB CO (US) 2023-08-03 US disclosed
US-20210128532-A1 HETEROCYCLIC CARBOXYLATE COMPOUNDS AS GLYCOLATE OXIDASE INHIBITORS Lilac Therapeutics, Inc. 2021-05-06 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 (3 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-11806335-B2 Heterocyclic carboxylate compounds as glycolate oxidase inhibitors UGDH, PGD, PNPO RAB9A 4019/4885NPC1 4018/4885GAA 28/4885
US-20230242535-A1 IMIDAZOTHIADIAZOLE AND IMIDAZOPYRAZINE DERIVATIVES AS PROTEASE ACTIVATED RECEPTOR 4 (PAR4) INHIBITORS FOR TREATING PLATELET AGGREGATION F2RL3, F2R, TMPRSS4 RAB9A 2789/4885NPC1 4167/4885GAA 4086/4885
US-20210128532-A1 HETEROCYCLIC CARBOXYLATE COMPOUNDS AS GLYCOLATE OXIDASE INHIBITORS UGDH, PGD, PNPO RAB9A 4019/4885NPC1 4018/4885GAA 28/4885

“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.