SCHEMBL12376660

SCHEMBL12376660

CC(C)(C)NC(=O)c1cc(Cl)cn(Cc2ccccc2)c1=O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 12/20 0.57
ALDH1A1 P00352 3/20 0.51
HPGD P15428 2/20 0.51
LMNA P02545 1/20 0.51
MAPT P10636 1/20 0.51
HTT P42858 1/20 0.51
ADRA1D P25100 1/20 0.50
BRD2 P25440 2/20 0.49
BRD3 Q15059 2/20 0.49
BRDT Q58F21 2/20 0.49
TRIM24 O15164 1/20 0.49
BRD1 O95696 1/20 0.49
CCL2 P13500 1/20 0.49
TAF1 P21675 1/20 0.49
SMARCA2 P51531 1/20 0.49
SMARCA4 P51532 1/20 0.49
BRPF1 P55201 1/20 0.49
EP300 Q09472 1/20 0.49
BPTF Q12830 1/20 0.49
CACNA1C Q13936 1/20 0.49

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
SCHEMBL12376655 0.88 BRD4 (0.57) BRD4ALDH1A1BRD2BRD3BRDT
SCHEMBL14460019 0.84 BRD4 (0.69) BRD4ALDH1A1HPGDLMNAMAPT
SCHEMBL2285071 0.81 ADRA1D (0.59) BRD4ALDH1A1HPGDLMNAMAPT
SCHEMBL15241737 0.81 BRD4 (0.54) BRD4ALDH1A1HPGDLMNAMAPT
SCHEMBL13101588 0.81 BRD4 (0.73) BRD4ALDH1A1LMNAMAPTHTT
SCHEMBL13101585 0.78 ALDH1A1 (0.51) BRD4ALDH1A1MAPTHTTBRD2
SCHEMBL8114228 0.74 ADRA1D (0.61) ALDH1A1HPGDLMNAMAPTHTT
SCHEMBL13234792 0.73 FLT3 (0.59) MEN1RAB9AKMT2A
SCHEMBL28377750 0.73 RAB9A (0.57) BRD4ALDH1A1HPGDLMNAMAPT
SCHEMBL18616245 0.73 BRD4 (0.76) BRD4ALDH1A1HPGDLMNAMAPT

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-8003662-B2 Heterobicyclic thiophene compounds and methods of use ARRAY BIOPHARMA, INC. (US) 2011-08-23 US disclosed
US-8003662-B2 Heterobicyclic thiophene compounds and methods of use ARRAY BIOPHARMA, INC. (US) 2011-08-23 US disclosed
US-20070197537-A1 Heterobicyclic thiophene compounds and methods of use ARRAY BIOPHARMA, INC. 2007-08-23 US 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-20070197537-A1 Heterobicyclic thiophene compounds and methods of use ERBB2, LCK, SRC BRD4 4102/4885ALDH1A1 1635/4885HPGD 1640/4885

“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.