SCHEMBL16082480

SCHEMBL16082480

O=C(NCc1ccccc1Cl)c1ccc2c(c1)ncn2-c1ccccc1

nearest known ligand 0.81

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 6/20 0.81
▸ LMNA P02545 2/20 0.71
▸ FGFR1 P11362 4/20 0.59
▸ TDP1 Q9NUW8 1/20 0.55
▸ RXFP1 Q9HBX9 1/20 0.55
▸ CASP6 P55212 1/20 0.54
▸ SMN1; SMN2 Q16637 2/20 0.53
▸ MAPT P10636 1/20 0.53
▸ MEN1 O00255 2/20 0.52
▸ KMT2A Q03164 2/20 0.52
▸ ALDH1A1 P00352 1/20 0.52
▸ HPGD P15428 2/20 0.52
▸ ROCK2 O75116 1/20 0.52

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
SCHEMBL16082522 0.92 TP53 (0.82) TP53LMNAFGFR1TDP1RXFP1
SCHEMBL16082486 0.90 TP53 (0.77) TP53LMNAFGFR1TDP1RXFP1
SCHEMBL16082518 0.90 TP53 (1.00) TP53LMNATDP1SMN1; SMN2MAPT
SCHEMBL16082498 0.90 TP53 (0.85) TP53LMNATDP1RXFP1CASP6
SCHEMBL16082482 0.88 TP53 (0.80) TP53LMNAFGFR1TDP1RXFP1
SCHEMBL16082478 0.88 TP53 (0.80) TP53LMNAFGFR1SMN1; SMN2MAPT
SCHEMBL16082912 0.86 TP53 (0.76) TP53LMNAFGFR1TDP1RXFP1
SCHEMBL16082484 0.85 TP53 (0.84) TP53LMNATDP1RXFP1CASP6
SCHEMBL16082520 0.85 TP53 (0.76) TP53LMNATDP1RXFP1CASP6
SCHEMBL16082499 0.85 TP53 (0.70) TP53LMNATDP1RXFP1CASP6

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 2199/4885FGFR1 3929/4885

“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.

Send feedback