SCHEMBL27193249

SCHEMBL27193249

Cc1cc(NC(=O)c2ccc(-c3ccc(C(=O)Nc4ccc([N+](C)(C)C)c(C)c4)cc3)cc2)ccc1[N+](C)(C)C

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 5/20 0.54
▸ NPC1 O15118 4/20 0.54
▸ KMT2A Q03164 4/20 0.54
▸ PTPN1 P18031 5/20 0.49
▸ FKBP5 Q13451 1/20 0.48
▸ MEN1 O00255 3/20 0.47
▸ MAPT P10636 2/20 0.47
▸ DEGS1 O15121 1/20 0.45
▸ NR1H4 Q96RI1 1/20 0.45
▸ TRPV1 Q8NER1 1/20 0.45
▸ MCHR1 Q99705 1/20 0.45
▸ KDM4E B2RXH2 1/20 0.44
▸ LMNA P02545 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44

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
SCHEMBL27193274 0.84 PTPN1 (0.55) RAB9ANPC1KMT2APTPN1MEN1
SCHEMBL27193307 0.84 MAPT (0.55) RAB9ANPC1KMT2APTPN1MEN1
SCHEMBL27193247 0.84 MAPT (0.51) RAB9ANPC1KMT2APTPN1MEN1
SCHEMBL27193221 0.81 NPC1 (0.58) RAB9ANPC1PTPN1TRPV1MCHR1
SCHEMBL27193260 0.80 MAPT (0.55) RAB9ANPC1KMT2APTPN1MEN1
SCHEMBL27193296 0.78 HTR1D (0.43) RAB9ANPC1KMT2APTPN1MEN1
SCHEMBL24628415 0.76 DEGS1 (0.60) RAB9ANPC1KMT2APTPN1FKBP5
SCHEMBL30828585 0.76 RAB9A (0.54) RAB9ANPC1KMT2APTPN1FKBP5
SCHEMBL27193298 0.76 PTPN1 (0.61) RAB9ANPC1KMT2APTPN1MEN1
SCHEMBL23226585 0.75 KMT2A (0.64) RAB9ANPC1KMT2APTPN1FKBP5

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-20240116857-A1 QUATERNARY AMMONIUM COMPOUNDS AS ANTIMICROBIALS SAINT LOUIS UNIVERSITY (US) 2024-04-11 — — 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-20240116857-A1 QUATERNARY AMMONIUM COMPOUNDS AS ANTIMICROBIALS ABCC1, ARG1, SLC11A2 RAB9A 1510/4885NPC1 2211/4885KMT2A 1571/4885

“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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