SCHEMBL16082482

SCHEMBL16082482

CCc1cccc(-n2cnc3cc(C(=O)NCc4ccccc4Cl)ccc32)c1

nearest known ligand 0.80

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 7/20 0.80
▸ LMNA P02545 2/20 0.65
▸ TDP1 Q9NUW8 1/20 0.58
▸ HPGD P15428 2/20 0.55
▸ KMT2A Q03164 4/20 0.51
▸ MEN1 O00255 3/20 0.51
▸ MAPK1 P28482 1/20 0.51
▸ SMN1; SMN2 Q16637 1/20 0.51
▸ NPC1 O15118 1/20 0.50
▸ FGFR1 P11362 1/20 0.49
▸ RXFP1 Q9HBX9 1/20 0.49
▸ ALDH1A1 P00352 1/20 0.48
▸ ROCK2 O75116 1/20 0.48
▸ CASP6 P55212 1/20 0.48

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
SCHEMBL16082486 0.91 TP53 (0.77) TP53LMNATDP1HPGDKMT2A
SCHEMBL16082518 0.89 TP53 (1.00) TP53LMNATDP1HPGDKMT2A
SCHEMBL16082480 0.88 TP53 (0.81) TP53LMNATDP1HPGDKMT2A
SCHEMBL16082523 0.87 TP53 (0.61) TP53LMNATDP1HPGDKMT2A
SCHEMBL16082478 0.87 TP53 (0.80) TP53LMNAHPGDKMT2AMEN1
SCHEMBL16082912 0.85 TP53 (0.76) TP53LMNATDP1HPGDKMT2A
SCHEMBL16082498 0.85 TP53 (0.85) TP53LMNATDP1HPGDKMT2A
SCHEMBL16082522 0.85 TP53 (0.82) TP53LMNATDP1HPGDKMT2A
SCHEMBL16082520 0.83 TP53 (0.76) TP53LMNATDP1HPGDKMT2A
SCHEMBL16082494 0.83 TP53 (0.75) TP53LMNATDP1HPGDKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9790188-B2 Benzimidazole derivatives and uses thereof WHITEHEAD INSTITUTE FOR BIOMEDICAL RESEARCH (US) 2017-10-17 — — US disclosed
US-20160031824-A1 BENZIMIDAZOLE DERIVATIVES AND USES THEREOF WHITEHEAD INSTITUTE FOR BIOMEDICAL RESEARCH (US) 2016-02-04 — — US disclosed
WO-2014145887-A1 BENZIMIDAZOLE DERIVATIVES AND USES THEREOF WHITEHEAD INSTITUTE FOR BIOMEDICAL RESEARCH (US) 2014-09-18 — — 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-20160031824-A1 BENZIMIDAZOLE DERIVATIVES AND USES THEREOF TARDBP, ADRM1, MDM2 TP53 50/4885LMNA 2199/4885TDP1 64/4885

“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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