SCHEMBL20715313

SCHEMBL20715313

COc1ccccc1NC(=O)Cn1c(C)nc2ccccc21

nearest known ligand 0.65

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.62
▸ NPC1 O15118 1/20 0.61
▸ LMNA P02545 3/20 0.60
▸ ALDH1A1 P00352 2/20 0.59
▸ GSK3B P49841 3/20 0.58
▸ CYP2C19 P33261 1/20 0.58
▸ MPO P05164 1/20 0.57
▸ TSHR P16473 1/20 0.57
▸ HTT P42858 1/20 0.57
▸ HPGD P15428 1/20 0.56
▸ POLB P06746 1/20 0.56
▸ MEN1 O00255 1/20 0.56
▸ KMT2A Q03164 1/20 0.56

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
SCHEMBL23120254 0.83 ALDH1A1 (0.81) MAPTNPC1LMNAALDH1A1GSK3B
SCHEMBL19714443 0.82 LMNA (0.60) MAPTLMNAALDH1A1CYP2C19MPO
SCHEMBL12497263 0.78 LMNA (0.69) LMNAGSK3BCYP2C19TSHRHTT
SCHEMBL12495433 0.78 ALDH1A1 (0.72) MAPTNPC1LMNAALDH1A1GSK3B
SCHEMBL20715449 0.78 KMT2A (0.76) MAPTNPC1LMNAALDH1A1GSK3B
SCHEMBL27858704 0.77 MMP2 (0.73) LMNAGSK3BCYP2C19TSHRHTT
SCHEMBL31134161 0.76 PIN1 (0.65) MAPTNPC1ALDH1A1TSHRHTT
SCHEMBL11400323 0.76 KDM4E (0.62) MAPTLMNAALDH1A1GSK3BCYP2C19
SCHEMBL2607501 0.76 GSK3B (0.69) MAPTLMNAALDH1A1GSK3BCYP2C19
SCHEMBL17824289 0.76 LMNA (0.66) LMNAGSK3BCYP2C19TSHRHTT

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-20200377505-A1 BENZIMIDAZOLES AND AZA-BENZIMIDAZOLES, AND METHODS OF USE THEREOF GFB (ABC), LLC 2020-12-03 — — US disclosed
WO-2019028308-A1 BENZIMIDAZOLES AND AZA-BENZIMIDAZOLES, AND METHODS OF USE THEREOF GOLDFINCH BIO, INC. (US) 2019-02-07 — — 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-20200377505-A1 BENZIMIDAZOLES AND AZA-BENZIMIDAZOLES, AND METHODS OF USE THEREOF AZI2, ATP6V1B1, GLS MAPT 4542/4885NPC1 2132/4885LMNA 3519/4885

“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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