SCHEMBL956877

SCHEMBL956877

Nc1ncc(SCc2ccccc2)s1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GRM4 Q14833 1/20 0.49
CDK2 P24941 1/20 0.49
RAB9A P51151 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
ALOX15 P16050 1/20 0.49
CA12 O43570 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA9 Q16790 1/20 0.46
POLB P06746 1/20 0.46
HSD17B10 Q99714 1/20 0.46
CXCR2 P25025 2/20 0.46
CYP3A4 P08684 1/20 0.46
NPC1 O15118 1/20 0.45
PAK4 O96013 2/20 0.43
MYC P01106 1/20 0.43
WDR5 P61964 1/20 0.43
HSP90AA1 P07900 1/20 0.41

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
SCHEMBL20583097 0.85 CDK2 (0.48) GRM4CDK2RAB9ASMN1; SMN2HSD17B10
SCHEMBL18613599 0.84 CDK2 (0.57) GRM4CDK2RAB9ASMN1; SMN2CXCR2
SCHEMBL20583155 0.81 CDK2 (0.50) GRM4CDK2RAB9ASMN1; SMN2ALOX15
SCHEMBL27174928 0.79 GRM4 (0.49) GRM4CDK2RAB9ASMN1; SMN2ALOX15
SCHEMBL27174952 0.79 GRM4 (0.52) GRM4CDK2CA12CA1CA2
SCHEMBL20583237 0.79 RAB9A (0.55) GRM4CDK2RAB9ASMN1; SMN2CYP3A4
SCHEMBL3898580 0.78 POLB (0.50) CDK2RAB9ASMN1; SMN2POLBNPC1
SCHEMBL3912591 0.78 DAO (0.48) CDK2RAB9A
SCHEMBL2591470 0.78 GAA (0.58) GRM4CDK2RAB9ASMN1; SMN2HSD17B10
SCHEMBL3904545 0.78 RAB9A (0.47) GRM4CDK2RAB9ASMN1; SMN2NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4573088-A1 HETEROCYCLE RBM39 MODULATORS Recursion Pharmaceuticals, Inc. (US) 2025-06-25 EP disclosed
CN-119630658-A Heterocyclic RBM39 modulators 递归医药公司 2025-03-14 CN disclosed
US-20240092770-A1 Heterocycle RMB39 Modulators RECURSION PHARMACEUTICALS, INC. 2024-03-21 US disclosed
WO-2024039689-A1 HETEROCYCLE RBM39 MODULATORS RECURSION PHARMACEUTICALS, INC. (US) 2024-02-22 WO disclosed
US-7868030-B2 FBPase inhibitors for diabetes HOFFMANN-LA ROCHE INC. (US) 2011-01-11 US disclosed
CN-101454301-A Thiazole derivatives HOFFMANN LA ROCHE (CH) 2009-06-10 CN disclosed
EP-2032548-A1 THIAZOLE DERIVATIVES F.HOFFMANN-LA ROCHE AG (CH) 2009-03-11 EP disclosed
WO-2007137962-A1 THIAZOLE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2007-12-06 WO disclosed
US-20070281979-A1 Fructose-1,6-bisphosphatase (FBPase) inhibitors, such as N-[(5-bromo-1,3-thiazol-2-yl)carbamoyl]3(difluoromethoxy)benzenesulfonamide, used as antidiabetic agents HOFFMANN-LA ROCHE INC. 2007-12-06 US disclosed
US-4254260-A 3-Substituted-7-substituted alkanamido-3-cephem-4-carboxylic acid compounds FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1981-03-03 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 (2 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-20070281979-A1 Fructose-1,6-bisphosphatase (FBPase) inhibitors, such as N-[(5-bromo-1,3-thiazol-2-yl)carbamoyl]3(difluoromethoxy)benzenesulfonamide, used as antidiabetic agents FBP1, PFKFB1, PFKFB3 GRM4 3538/4885CDK2 520/4885RAB9A 1955/4885
US-20240092770-A1 Heterocycle RMB39 Modulators PRMT9, RCC2, RBBP9 GRM4 2831/4885CDK2 1273/4885RAB9A 37/4885

“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.