SCHEMBL30469983

SCHEMBL30469983

COC1(c2nc3cc(Cl)ccc3s2)CCNCC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
LOXL2 Q9Y4K0 1/20 0.40
IDO1 P14902 1/20 0.40
PPARA Q07869 4/20 0.38
AGPAT2 O15120 1/20 0.36
HDAC6 Q9UBN7 1/20 0.35
HTR3E A5X5Y0 1/20 0.35
HTR3B O95264 1/20 0.35
HTR3A P46098 1/20 0.35
HTR3D Q70Z44 1/20 0.35
HTR3C Q8WXA8 1/20 0.35
MGAM O43451 1/20 0.34
GAA P10253 1/20 0.34
SI P14410 1/20 0.34
MGAM2 Q2M2H8 1/20 0.34
HTT P42858 1/20 0.34
CASP3 P42574 1/20 0.34

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
SCHEMBL24367034 1.00 NPC1 (0.48) NPC1RAB9ASMN1; SMN2NPSR1LOXL2
SCHEMBL24367032 0.84 HRH4 (0.43) NPC1RAB9ASMN1; SMN2NPSR1LOXL2
SCHEMBL30470716 0.84 HRH4 (0.43) NPC1RAB9ASMN1; SMN2NPSR1LOXL2
SCHEMBL30470829 0.80 NPC1 (0.51) NPC1RAB9ASMN1; SMN2NPSR1LOXL2
SCHEMBL24365338 0.80 NPC1 (0.51) NPC1RAB9ASMN1; SMN2NPSR1LOXL2
SCHEMBL25320313 0.80 NPC1 (0.51) NPC1RAB9ASMN1; SMN2NPSR1LOXL2
SCHEMBL30470244 0.75 MEN1 (0.41) NPC1RAB9APPARACYP3A4CYP2C9
SCHEMBL24367038 0.75 MEN1 (0.41) NPC1RAB9APPARACYP3A4CYP2C9
SCHEMBL23088599 0.72 PIK3CA (0.51) NPC1RAB9ASMN1; SMN2GAAHTT
SCHEMBL24365172 0.68 SMN1; SMN2 (0.44) NPC1RAB9ASMN1; SMN2NPSR1LOXL2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260078117-A1 COMPOUNDS AND METHODS OF USE TANGO THERAPEUTICS INC (US) 2026-03-19 US disclosed
EP-4188920-A1 PIPERIDIN-1-YL-N-PYRYDINE-3-YL-2-OXOACETAMIDE DERIVATIVES USEFUL FOR THE TREATMENT OF MTAP-DEFICIENT AND/OR MTA-ACCUMULATING CANCERS Tango Therapeutics, Inc. (US) 2023-06-07 EP 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-20260078117-A1 COMPOUNDS AND METHODS OF USE NR3C2, ADRA1A, CNR1 NPC1 24/4885RAB9A 420/4885SMN1; SMN2 1645/4885

“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.