SCHEMBL6987890

SCHEMBL6987890

CC(Cl)c1cc2cccc(Cl)c2nc1-c1ccccc1Cl

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 12/20 0.54
ALDH1A1 P00352 2/20 0.40
KDM4E B2RXH2 1/20 0.40
GLA P06280 1/20 0.40
TSPO P30536 5/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
TSHR P16473 1/20 0.39
BLM P54132 1/20 0.39
PMP22 Q01453 1/20 0.39
NR1I3 Q14994 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
ATM Q13315 1/20 0.38

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
SCHEMBL6985999 0.87 PIK3CD (0.56) PIK3CDALDH1A1KDM4EGLATSPO
SCHEMBL10251837 0.84 PIK3CD (0.43) PIK3CDALDH1A1ATM
Hydrochloric Acid SCHEMBL4174758 0.83 PIK3CD (0.43) PIK3CDALDH1A1ATM
SCHEMBL10250927 0.78 PIK3CD (0.65) PIK3CDALDH1A1KDM4EGLATSPO
SCHEMBL1598367 0.78 CTSA (0.38) PIK3CDALDH1A1KDM4E
SCHEMBL4176627 0.78 PIK3CD (0.68) PIK3CDALDH1A1GLACYP3A4ATM
SCHEMBL27802815 0.78 PIK3CD (0.45) PIK3CDALDH1A1KDM4EGLATSPO
SCHEMBL4433317 0.77 PIK3CD (0.47) PIK3CDALDH1A1GLACYP3A4ATM
SCHEMBL4173842 0.77 PIK3CD (0.47) PIK3CDALDH1A1GLACYP3A4ATM
SCHEMBL1313288 0.75 KDM4E (0.44) PIK3CDALDH1A1KDM4EGLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8183259-B2 Heterocyclic compounds and their uses AMGEN INC. (US) 2012-05-22 US disclosed
US-20110275653-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. (US) 2011-11-10 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-20110275653-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES MCL1, BCL9, MALT1 PIK3CD 16/4885ALDH1A1 3905/4885KDM4E 1806/4885

“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.