SCHEMBL18101352

SCHEMBL18101352

CC(C)c1csc(N2CCCC2)n1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OGA O60502 1/20 0.50
AR P10275 4/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
TP53 P04637 2/20 0.46
ALOX15 P16050 1/20 0.46
HSD17B10 Q99714 1/20 0.46
RAB9A P51151 4/20 0.44
PIK3CG P48736 1/20 0.40
POLB P06746 3/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
NPC1 O15118 1/20 0.39
LMNA P02545 2/20 0.39
TLR8 Q9NR97 1/20 0.39
TLR7 Q9NYK1 1/20 0.39
ALDH1A1 P00352 4/20 0.36
MAPT P10636 1/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
HPGD P15428 2/20 0.35
UCHL1 P09936 1/20 0.35

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
SCHEMBL12869754 0.98 OGA (0.49) OGAARSMN1; SMN2TP53ALOX15
SCHEMBL11703124 0.86 OGA (0.51) OGASMN1; SMN2RAB9APOLBMEN1
Hydrochloric Acid SCHEMBL11700234 0.84 OGA (0.50) OGASMN1; SMN2RAB9APOLBMEN1
SCHEMBL15341959 0.84 OGA (0.56) OGAPOLBLMNAALDH1A1MAPT
SCHEMBL13996106 0.84 LMNA (0.58) OGAARSMN1; SMN2RAB9AMEN1
Hydrochloric Acid SCHEMBL17541567 0.83 OGA (0.46) OGALMNAALDH1A1
SCHEMBL12506144 0.82 OGA (0.45) OGASMN1; SMN2RAB9AMEN1KMT2A
SCHEMBL24362458 0.81 AR (0.46) OGAARSMN1; SMN2TP53ALOX15
SCHEMBL19283752 0.79 RAB9A (0.48) OGASMN1; SMN2HSD17B10RAB9ANPC1
SCHEMBL24467438 0.76 SMN1; SMN2 (0.45) OGAARSMN1; SMN2TP53ALOX15

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
EP-3950059-A1 USE OF T-TYPE CALCIUM CHANNEL BLOCKER FOR TREATING PRURITUS Nippon Chemiphar Co., Ltd. (JP) 2022-02-09 EP disclosed
US-9957219-B2 Antidiabetic bicyclic compounds MERCK SHARP & DOHME CORP. (US) 2018-05-01 US disclosed
US-9957219-B2 Antidiabetic bicyclic compounds MERCK SHARP & DOHME CORP. (US) 2018-05-01 US disclosed
US-20160280626-A1 ANTIDIABETIC BICYCLIC COMPOUNDS MERCK SHARP & DOHME LLC 2016-09-29 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-20160280626-A1 ANTIDIABETIC BICYCLIC COMPOUNDS GPR119, GPR65, GLP1R OGA 1591/4885AR 811/4885SMN1; SMN2 4738/4885

“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.