SCHEMBL30520170

SCHEMBL30520170

O=C1Nc2ccccc2SC1=Cc1cccs1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 7/20 1.00
▸ NPC1 O15118 6/20 1.00
▸ HTT P42858 1/20 1.00
▸ GSK3B P49841 1/20 0.66
▸ PIM1 P11309 1/20 0.62
▸ MAPT P10636 7/20 0.61
▸ KMT2A Q03164 7/20 0.61
▸ MEN1 O00255 6/20 0.61
▸ SMN1; SMN2 Q16637 5/20 0.58
▸ MAPK1 P28482 2/20 0.58
▸ CASP3 P42574 1/20 0.58
▸ SENP8 Q96LD8 1/20 0.58
▸ SENP7 Q9BQF6 1/20 0.58
▸ SENP6 Q9GZR1 1/20 0.58
▸ POLB P06746 2/20 0.58
▸ TDP1 Q9NUW8 1/20 0.58
▸ ALDH1A1 P00352 2/20 0.53
▸ CDC25A P30304 3/20 0.51
▸ CDC25B P30305 3/20 0.51
▸ LMNA P02545 3/20 0.50

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
SCHEMBL1250017 0.80 GSK3B (1.00) RAB9ANPC1HTTGSK3BPIM1
SCHEMBL1250019 0.80 GSK3B (1.00) RAB9ANPC1HTTGSK3BPIM1
SCHEMBL8085249 0.78 PIM1 (0.67) RAB9ANPC1HTTPIM1MAPT
SCHEMBL15571574 0.78 PIM1 (0.67) RAB9ANPC1HTTPIM1MAPT
SCHEMBL8085252 0.78 PIM1 (0.67) RAB9ANPC1HTTPIM1MAPT
SCHEMBL8178919 0.77 PIM1 (1.00) RAB9ANPC1HTTGSK3BPIM1
SCHEMBL8176936 0.77 PIM1 (1.00) RAB9ANPC1HTTGSK3BPIM1
SCHEMBL10817032 0.73 PIM1 (0.67) RAB9ANPC1HTTPIM1MAPT
SCHEMBL10805356 0.73 PIM1 (0.67) RAB9ANPC1HTTGSK3BPIM1
SCHEMBL10817027 0.73 PIM1 (0.67) RAB9ANPC1HTTPIM1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230286934-A1 Use of Multi-Kinase Inhibitors to Treat RNA Virus Infections ICAHN SCHOOL MED MOUNT SINAI (US) 2023-09-14 — — 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-20230286934-A1 Use of Multi-Kinase Inhibitors to Treat RNA Virus Infections EIF2AK2, SARS1, ACE2 RAB9A 1744/4885NPC1 1643/4885HTT 1538/4885

“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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