SCHEMBL26965397

SCHEMBL26965397

COc1ccc(OC(=S)c2ccccc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.56
RAB9A P51151 3/20 0.56
SMN1; SMN2 Q16637 3/20 0.56
CES2 O00748 1/20 0.55
CES1 P23141 1/20 0.55
CYP1A2 P05177 2/20 0.51
CYP2C19 P33261 2/20 0.51
MAPT P10636 2/20 0.51
CYP3A4 P08684 2/20 0.51
CYP2C9 P11712 1/20 0.51
CA4 P22748 1/20 0.50
LTA4H P09960 1/20 0.48
GAA P10253 2/20 0.47
ALDH1A1 P00352 2/20 0.47
HTT P42858 2/20 0.47
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
CA1 P00915 2/20 0.45
CA2 P00918 2/20 0.45
PTGS2 P35354 1/20 0.45

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
SCHEMBL23731488 0.94 NPC1 (0.54) NPC1RAB9ASMN1; SMN2CES2CES1
SCHEMBL3087539 0.85 ELANE (0.42) MAPTLTA4HGAAALDH1A1MEN1
SCHEMBL7583060 0.85 ELANE (0.42) MAPTLTA4HGAAALDH1A1MEN1
SCHEMBL8834811 0.81 ELANE (0.42) NPC1RAB9ACYP1A2CYP2C19MAPT
SCHEMBL19943304 0.80 KMT2A (0.44) NPC1RAB9AALDH1A1MEN1KMT2A
SCHEMBL28415280 0.80 CES2 (0.45) NPC1RAB9ASMN1; SMN2CES2CES1
Thiobenzoic Acid SCHEMBL2253615 0.79 ELANE (0.38) MAPTLTA4HGAAALDH1A1HTT
SCHEMBL2469364 0.79 CA4 (0.61) NPC1RAB9ASMN1; SMN2CES2CES1
SCHEMBL1710693 0.79 NPC1 (0.43) NPC1RAB9ASMN1; SMN2CES2CES1
SCHEMBL1710824 0.78 CYP1A2 (0.55) RAB9ACYP1A2CYP2C19MAPTCYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116917271-B Process for producing arylthiol ester compound AGC株式会社 2026-05-15 CN disclosed
US-20230406819-A1 METHOD FOR PRODUCING ARYL THIOL ESTER COMPOUND AGC Inc. (JP) 2023-12-21 US disclosed
CN-116940551-A Method for producing aryl compound containing pentafluorothio group AGC株式会社 2023-10-24 CN disclosed
CN-116917271-A Process for producing arylthiol ester compound AGC株式会社 2023-10-20 CN 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-20230406819-A1 METHOD FOR PRODUCING ARYL THIOL ESTER COMPOUND TST, SULT1A1, STS NPC1 1332/4885RAB9A 4172/4885SMN1; SMN2 3929/4885

“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.