SCHEMBL25349620

SCHEMBL25349620

COc1nc2nc[nH]c2cc1Br

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDPK1 O15530 1/20 0.42
▸ MMP12 P39900 1/20 0.38
▸ ALDH1A1 P00352 2/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ QPCT Q16769 1/20 0.37
▸ QPCTL Q9NXS2 1/20 0.37
▸ SMN1; SMN2 Q16637 3/20 0.37
▸ HTT P42858 2/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ PRNP P04156 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ AXL P30530 1/20 0.36
▸ SRC P12931 1/20 0.34
▸ SCD O00767 1/20 0.33
▸ LMNA P02545 1/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.32
▸ RXFP1 Q9HBX9 1/20 0.32
▸ GRIN2D O15399 1/20 0.32

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
SCHEMBL3731437 0.81 PDPK1 (0.43) PDPK1MMP12ALDH1A1KDM4EQPCT
SCHEMBL28798557 0.78 SRC (0.56) PDPK1ALDH1A1SMN1; SMN2HPGDSRC
SCHEMBL3047163 0.77 HPGD (0.43) ALDH1A1KDM4ESMN1; SMN2HTTMEN1
SCHEMBL30640951 0.73 PARP1 (0.41) PDPK1ALDH1A1KDM4EQPCTHPGD
SCHEMBL23101036 0.73 NPSR1 (0.39) MMP12KDM4EQPCTSMN1; SMN2MEN1
SCHEMBL30640970 0.73 GAA (0.40) PDPK1ALDH1A1KDM4EQPCTKMT2A
SCHEMBL23832157 0.72 MMP12 (0.38) PDPK1MMP12ALDH1A1KDM4EQPCT
SCHEMBL17450949 0.70 CA2 (0.42) ALDH1A1PRNPMAPTAXLNPSR1
SCHEMBL17265808 0.70 ALDH1A1 (0.52) PDPK1ALDH1A1KDM4EMAPTHPGD
SCHEMBL11314842 0.69 ALDH1A1 (0.40) MMP12ALDH1A1KDM4ESMN1; SMN2HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240043420-A1 7-AZAINDOLE COMPOUNDS FOR INHIBITION OF BCR-ABL TYROSINE KINASES ENLIVEN INC. 2024-02-08 — — US disclosed
EP-4225741-A1 7-AZAINDOLE COMPOUNDS FOR INHIBITION OF BCR-ABL TYROSINE KINASES Enliven Therapeutics, Inc. (US) 2023-08-16 — — EP disclosed
CN-116438182-A 7-azaindole compounds for inhibiting BCR-ABL tyrosine kinase 活力疗法公司 2023-07-14 — — CN disclosed
WO-2022076973-A1 7-AZAINDOLE COMPOUNDS FOR INHIBITION OF BCR-ABL TYROSINE KINASES ENLIVEN THERAPEUTICS, INC. (US) 2022-04-14 — — 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-20240043420-A1 7-AZAINDOLE COMPOUNDS FOR INHIBITION OF BCR-ABL TYROSINE KINASES ABL1, ABL2, BCR PDPK1 428/4885MMP12 2525/4885ALDH1A1 1355/4885

“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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