SCHEMBL12164952

SCHEMBL12164952

Cc1ccc2c(c1)C(O)(c1ccccc1)C(N)=N2

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 5/20 0.37
▸ NPSR1 Q6W5P4 2/20 0.37
▸ TDP1 Q9NUW8 2/20 0.37
▸ CASP3 P42574 1/20 0.37
▸ ATM Q13315 1/20 0.37
▸ SENP8 Q96LD8 1/20 0.37
▸ SENP7 Q9BQF6 1/20 0.37
▸ SENP6 Q9GZR1 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ MAPT P10636 5/20 0.36
▸ KMT2A Q03164 4/20 0.36
▸ KDM4E B2RXH2 4/20 0.36
▸ MEN1 O00255 3/20 0.36
▸ CYP3A4 P08684 2/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ CYP2D6 P10635 1/20 0.36
▸ CYP2C9 P11712 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ ALOX15 P16050 1/20 0.36
▸ CASP1 P29466 1/20 0.36

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
SCHEMBL12165054 0.83 ALOX5AP (0.34) PDK2EHMT2P2RX1P2RX3P2RX4
SCHEMBL12164937 0.82 BACE1 (0.36) PDK2SMN1; SMN2BACE1P2RX1P2RX3
SCHEMBL12164883 0.82 SCN9A (0.37) KMT2APDK2SMN1; SMN2BACE1P2RX1
SCHEMBL12164888 0.82 SCN9A (0.37) KMT2APDK2SMN1; SMN2BACE1P2RX1
SCHEMBL12164960 0.82 MEN1 (0.39) NPSR1MAPTKMT2AKDM4EMEN1
SCHEMBL12653484 0.82 P2RX1 (0.32) P2RX1P2RX3P2RX4P2RX7
SCHEMBL12165104 0.82 MEN1 (0.38) RAB9ATDP1MAPTKMT2AKDM4E
SCHEMBL12164884 0.82 SCN9A (0.37) KMT2APDK2SMN1; SMN2BACE1P2RX1
SCHEMBL12165365 0.82 GABRA1 (0.35) P2RX1P2RX3P2RX4P2RX7
SCHEMBL12165041 0.81 PDK2 (0.39) RAB9ANPSR1TDP1L3MBTL1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8980926-B2 2-aminoindole compounds and methods for the treatment of malaria GENZYME CORPORATION (US) 2015-03-17 — — US disclosed
US-8980926-B2 2-aminoindole compounds and methods for the treatment of malaria GENZYME CORPORATION (US) 2015-03-17 — — US disclosed
US-20120232063-A1 2-Aminoindole Compounds And Methods For The Treatment Of Malaria MASSACHUSETTS INSTITUTE OF TECHNOLOGY 2012-09-13 — — US disclosed
US-20120232063-A1 2-Aminoindole Compounds And Methods For The Treatment Of Malaria MASSACHUSETTS INSTITUTE OF TECHNOLOGY 2012-09-13 — — US disclosed
WO-2011053697-A1 2-AMINOINDOLE COMPOUNDS AND METHODS FOR THE TREATMENT OF MALARIA GENZYME CORPORATION (US) 2011-05-05 — — WO 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-20120232063-A1 2-Aminoindole Compounds And Methods For The Treatment Of Malaria PNMT, AADAT, INMT RAB9A 3481/4885NPSR1 1819/4885TDP1 3238/4885

“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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