SCHEMBL12296355

SCHEMBL12296355

CC(C)(C)c1csc(NC(=O)c2cccs2)n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 12/20 1.00
▸ RAB9A P51151 11/20 1.00
▸ LMNA P02545 6/20 1.00
▸ NPSR1 Q6W5P4 4/20 1.00
▸ HSD17B10 Q99714 4/20 1.00
▸ ALDH1A1 P00352 4/20 1.00
▸ MAPK1 P28482 4/20 1.00
▸ ALOX15 P16050 3/20 1.00
▸ TSHR P16473 3/20 1.00
▸ HPGD P15428 2/20 1.00
▸ SMN1; SMN2 Q16637 4/20 0.68
▸ KDM4E B2RXH2 4/20 0.66
▸ HTT P42858 4/20 0.66
▸ MAPT P10636 3/20 0.66
▸ TAS1R3 Q7RTX0 1/20 0.65
▸ TAS1R1 Q7RTX1 1/20 0.65
▸ TAS1R2 Q8TE23 1/20 0.65
▸ MEN1 O00255 6/20 0.63
▸ KMT2A Q03164 6/20 0.63
▸ POLB P06746 2/20 0.63

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
SCHEMBL20787903 0.81 NPC1 (0.74) NPC1RAB9ALMNANPSR1HSD17B10
SCHEMBL77592 0.80 SMN1; SMN2 (0.77) NPC1RAB9ALMNANPSR1HSD17B10
SCHEMBL20769725 0.79 RAB9A (0.65) NPC1RAB9ALMNANPSR1HSD17B10
SCHEMBL704723 0.79 SMN1; SMN2 (1.00) NPC1RAB9ALMNANPSR1HSD17B10
SCHEMBL20787910 0.78 NPC1 (1.00) NPC1RAB9ALMNANPSR1HSD17B10
SCHEMBL20791856 0.78 NPC1 (0.70) NPC1RAB9ALMNANPSR1HSD17B10
SCHEMBL22728466 0.78 NPC1 (0.66) NPC1RAB9ALMNANPSR1HSD17B10
SCHEMBL20787908 0.78 NPC1 (0.64) NPC1RAB9ALMNANPSR1HSD17B10
SCHEMBL20791858 0.77 SMN1; SMN2 (0.77) NPC1RAB9ALMNANPSR1HSD17B10
SCHEMBL77958 0.77 SMN1; SMN2 (0.77) NPC1RAB9ALMNANPSR1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8920785-B2 Cosmetic or dermatological preparations with a content of one or more thiazole derivates BEIERSDORF AG (DE) 2014-12-30 — — US disclosed
US-8920785-B2 Cosmetic or dermatological preparations with a content of one or more thiazole derivates BEIERSDORF AG (DE) 2014-12-30 — — US disclosed
US-20130039870-A1 Cosmetic Or Dermatological Preparations With A Content Of One Or More Thiazole Derivates BEIERSDORF AG (DE) 2013-02-14 — — US disclosed
US-20130039870-A1 Cosmetic Or Dermatological Preparations With A Content Of One Or More Thiazole Derivates BEIERSDORF AG (DE) 2013-02-14 — — US disclosed
WO-2011117034-A2 COSMETIC OR DERMATOLOGICAL PREPARATIONS WITH A CONTENT OF ONE OR MORE THIAZOLE DERIVATIVES BEIERSDORF AG (DE) 2011-09-29 — — 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-20130039870-A1 Cosmetic Or Dermatological Preparations With A Content Of One Or More Thiazole Derivates TYR, CUTA, MITF NPC1 693/4885RAB9A 3404/4885LMNA 1518/4885

“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.

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