SCHEMBL17618191

SCHEMBL17618191

Brc1ccc(N(c2ccccc2)c2ccc(-c3cccs3)cc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 2/20 0.48
BCR P11274 2/20 0.48
ALDH1A1 P00352 5/20 0.43
KDM4E B2RXH2 5/20 0.43
MAPT P10636 5/20 0.43
TDP1 Q9NUW8 3/20 0.43
NPC1 O15118 2/20 0.43
CASP3 P42574 2/20 0.43
RAB9A P51151 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
SENP7 Q9BQF6 2/20 0.43
HPGD P15428 2/20 0.43
LTA4H P09960 1/20 0.43
TSHR P16473 1/20 0.43
SENP8 Q96LD8 1/20 0.43
HSD17B10 Q99714 1/20 0.43
SENP6 Q9GZR1 1/20 0.43
APP P05067 1/20 0.41
MAPK1 P28482 1/20 0.41
CYP17A1 P05093 1/20 0.39

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
SCHEMBL14253104 0.91 LTA4H (0.50) ABL1BCRALDH1A1KDM4EMAPT
SCHEMBL867469 0.91 LTA4H (0.50) ABL1BCRALDH1A1KDM4EMAPT
SCHEMBL15591131 0.90 LTA4H (0.48) ABL1BCRALDH1A1KDM4EMAPT
SCHEMBL8014120 0.86 LTA4H (0.55) ABL1BCRALDH1A1KDM4EMAPT
SCHEMBL2344484 0.86 LTA4H (0.55) ABL1BCRALDH1A1KDM4EMAPT
SCHEMBL14192249 0.84 LTA4H (0.53) ABL1BCRALDH1A1KDM4EMAPT
SCHEMBL15591130 0.84 LTA4H (0.53) ABL1BCRALDH1A1KDM4EMAPT
SCHEMBL10029848 0.84 LTA4H (0.53) ABL1BCRALDH1A1KDM4EMAPT
SCHEMBL1310724 0.84 ABL1 (0.60) ABL1BCRALDH1A1KDM4EMAPT
SCHEMBL14680785 0.82 LTA4H (0.47) ABL1BCRALDH1A1KDM4EMAPT

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-9515268-B2 Aromatic amine derivatives and preparation method, uses and organic electroluminescent devices thereof BOE TECHNOLOGY GROUP CO., LTD. (CN) 2016-12-06 US disclosed
US-9515268-B2 Aromatic amine derivatives and preparation method, uses and organic electroluminescent devices thereof BOE TECHNOLOGY GROUP CO., LTD. (CN) 2016-12-06 US disclosed
US-20160087221-A1 AROMATIC AMINE DERIVATIVES AND PREPARATION METHOD, USES AND ORGANIC ELECTROLUMINESCENT DEVICES THEREOF BOE TECHNOLOGY GROUP CO., LTD. (CN) 2016-03-24 US disclosed
US-20160087221-A1 AROMATIC AMINE DERIVATIVES AND PREPARATION METHOD, USES AND ORGANIC ELECTROLUMINESCENT DEVICES THEREOF BOE TECHNOLOGY GROUP CO., LTD. (CN) 2016-03-24 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-20160087221-A1 AROMATIC AMINE DERIVATIVES AND PREPARATION METHOD, USES AND ORGANIC ELECTROLUMINESCENT DEVICES THEREOF C1S, C5, C9 ABL1 644/4885BCR 561/4885ALDH1A1 709/4885

“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.