SCHEMBL30816117

SCHEMBL30816117

COC(=O)c1c(C(=O)OC)c2c(Br)cc3ccccc3n2c1C(=O)c1ccc(OC)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 5/20 0.42
▸ NPC1 O15118 4/20 0.42
▸ KMT2A Q03164 3/20 0.40
▸ MEN1 O00255 2/20 0.40
▸ ALDH1A1 P00352 2/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ AHR P35869 1/20 0.40
▸ LMNA P02545 2/20 0.39
▸ MAPT P10636 1/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ RXFP1 Q9HBX9 1/20 0.39
▸ CA1 P00915 1/20 0.39
▸ CA2 P00918 1/20 0.39
▸ KDM4E B2RXH2 2/20 0.39
▸ POLB P06746 2/20 0.39
▸ CNR1 P21554 1/20 0.38
▸ CNR2 P34972 1/20 0.38
▸ CASP3 P42574 1/20 0.38
▸ SENP7 Q9BQF6 1/20 0.38

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
SCHEMBL30816073 0.91 MAPT (0.41) RAB9AKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL30816138 0.91 HPGD (0.41) RAB9ANPC1KMT2AMEN1ALDH1A1
SCHEMBL30816139 0.89 KMT2A (0.39) KMT2AMEN1ALDH1A1SMN1; SMN2MAPT
SCHEMBL30816031 0.89 KMT2A (0.39) NPC1KMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL27156311 0.88 RAB9A (0.40) RAB9ANPC1KMT2AMEN1ALDH1A1
SCHEMBL30816197 0.87 TRPA1 (0.41) RAB9ANPC1KMT2AMEN1ALDH1A1
SCHEMBL27156314 0.76 DAO (0.37) RAB9ANPC1KMT2AMEN1ALDH1A1
SCHEMBL27156306 0.75 AKR1C3 (0.43) KMT2AMEN1ALDH1A1SMN1; SMN2LMNA
SCHEMBL27156302 0.74 FNTA (0.44) RAB9ANPC1KMT2AMEN1ALDH1A1
SCHEMBL27156307 0.73 NR4A1 (0.42) RAB9ANPC1KMT2AMEN1ALDH1A1

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-11919900-B1 1-substituted benzoyl-4-bromopyrrolo[1,2-a]quinoline-3-carboxylate derivatives as antitubercular agents King Faisal University (SA) 2024-03-05 — — US claimed
US-11919900-B1 1-substituted benzoyl-4-bromopyrrolo[1,2-a]quinoline-3-carboxylate derivatives as antitubercular agents King Faisal University (SA) 2024-03-05 — — 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-11919900-B1 1-substituted benzoyl-4-bromopyrrolo[1,2-a]quinoline-3-carboxylate derivatives as antitubercular agents BRD4, BET1, TALDO1 RAB9A 984/4885NPC1 931/4885KMT2A 3348/4885

“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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