SCHEMBL16169648

SCHEMBL16169648

Cc1ccc2c3ccc(Br)cc3n(CCCN)c2c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HASPIN Q8TF76 10/20 0.41
HPGD P15428 2/20 0.41
DYRK1A Q13627 1/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
HSD17B10 Q99714 1/20 0.41
SIGMAR1 Q99720 1/20 0.37
TLR8 Q9NR97 2/20 0.37
GLA P06280 1/20 0.36
APEX1 P27695 1/20 0.36
SYK P43405 1/20 0.36
RECQL P46063 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
CYP1A2 P05177 1/20 0.36
TSHR P16473 1/20 0.36
PIM1 P11309 1/20 0.34
CSNK2A2 P19784 1/20 0.34
CSNK2B P67870 1/20 0.34
CSNK2A1 P68400 1/20 0.34
CSNK2A3 Q8NEV1 1/20 0.34

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
SCHEMBL15138940 0.91 HASPIN (0.43) HASPINHPGDDYRK1ASIGMAR1GLA
SCHEMBL17704935 0.86 RORA (0.46) DYRK1AKDM4EALDH1A1SIGMAR1TLR8
SCHEMBL17699268 0.77 PSEN1 (0.44) DYRK1AKDM4EALDH1A1SIGMAR1TDP1
SCHEMBL12780411 0.77 HPGD (0.57) HASPINHPGDKDM4EALDH1A1HSD17B10
SCHEMBL13374193 0.77 ALDH1A1 (0.41) HPGDKDM4EALDH1A1TSHR
Hydrochloric Acid SCHEMBL1127942 0.76 HPGD (0.59) HASPINHPGDKDM4EALDH1A1HSD17B10
SCHEMBL31171943 0.75 SIGMAR1 (0.40) HASPINSIGMAR1
SCHEMBL18947670 0.75 RORA (0.53) DYRK1AKDM4EALDH1A1TLR8TDP1
SCHEMBL15236168 0.74 HASPIN (0.71) HASPINDYRK1ACYP1A2DYRK2
SCHEMBL1287901 0.74 PSEN1 (0.52)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140308317-A1 Polymeric Compounds And Methods Of Making And Using The Same CELLCEUTIX CORPORATION (US) 2014-10-16 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-20140308317-A1 Polymeric Compounds And Methods Of Making And Using The Same ALG1, CD44, MUC1 HASPIN 420/4885HPGD 1018/4885DYRK1A 4628/4885

“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.