SCHEMBL21468476

SCHEMBL21468476

CC(C)(C)c1ncc(C(=O)Nc2ccc3c(c2)CCCCC3)s1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 15/20 0.52
▸ NPC1 O15118 12/20 0.52
▸ SMN1; SMN2 Q16637 11/20 0.52
▸ NFKB1 P19838 8/20 0.52
▸ NFKB2 Q00653 8/20 0.52
▸ RELA Q04206 8/20 0.52
▸ MEN1 O00255 2/20 0.52
▸ KMT2A Q03164 2/20 0.52
▸ POLB P06746 1/20 0.52
▸ CASP3 P42574 1/20 0.52
▸ SENP8 Q96LD8 1/20 0.52
▸ SENP7 Q9BQF6 1/20 0.52
▸ SENP6 Q9GZR1 1/20 0.52
▸ MAPT P10636 7/20 0.51
▸ TP53 P04637 5/20 0.51
▸ LMNA P02545 2/20 0.50
▸ HTT P42858 2/20 0.48
▸ ALDH1A1 P00352 4/20 0.47
▸ KDM4E B2RXH2 1/20 0.46
▸ PKM P14618 1/20 0.46

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
SCHEMBL21499351 0.85 PDE7A (0.47) RAB9ANPC1SMN1; SMN2NFKB1NFKB2
SCHEMBL21468460 0.79 DHODH (0.59) RAB9ANPC1SMN1; SMN2MEN1KMT2A
SCHEMBL21499310 0.76 RXRA (0.37) RAB9ANPC1SMN1; SMN2MEN1KMT2A
SCHEMBL18407360 0.76 PTPN1 (0.56) RAB9ANPC1SMN1; SMN2MEN1KMT2A
SCHEMBL21468516 0.74 NPC1 (0.68) RAB9ANPC1SMN1; SMN2NFKB1NFKB2
SCHEMBL17936101 0.74 BTK (0.41) RAB9ANPC1SMN1; SMN2MEN1KMT2A
SCHEMBL21468501 0.72 DHODH (0.39) RAB9ANPC1SMN1; SMN2NFKB1NFKB2
SCHEMBL28255492 0.71 NPC1 (0.71) RAB9ANPC1SMN1; SMN2NFKB1NFKB2
SCHEMBL21133751 0.69 POLB (0.46) RAB9ANPC1POLBMAPTHTT
SCHEMBL2244056 0.69 BAZ2B (0.67) RAB9ANPC1SMN1; SMN2NFKB1NFKB2

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-10450263-B2 Benzo annulenes as antiviral agents SOUTHERN RESEARCH INSTITUTE (US) 2019-10-22 — — US disclosed
US-10450263-B2 Benzo annulenes as antiviral agents SOUTHERN RESEARCH INSTITUTE (US) 2019-10-22 — — 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-10450263-B2 Benzo annulenes as antiviral agents MAVS, ZC3HAV1, GABBR1 RAB9A 1314/4885NPC1 908/4885SMN1; SMN2 804/4885

“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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