SCHEMBL21705927

SCHEMBL21705927

CCC(O)c1cc2cccc(C)c2nc1-c1ccccc1Cl

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 12/20 0.58
ATM Q13315 1/20 0.47
TSPO P30536 5/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.41
TSHR P16473 1/20 0.41
ALDH1A1 P00352 1/20 0.41
BLM P54132 1/20 0.41
PMP22 Q01453 1/20 0.41
NR1I3 Q14994 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
MGAM O43451 1/20 0.40
GAA P10253 1/20 0.40
SI P14410 1/20 0.40
MGAM2 Q2M2H8 1/20 0.40

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
SCHEMBL4181122 0.86 PIK3CD (0.54) PIK3CDATMMGAMGAASI
SCHEMBL10250927 0.86 PIK3CD (0.65) PIK3CDATMTSPOMEN1KMT2A
SCHEMBL1880588 0.82 ATM (0.45) PIK3CDATMTSHRALDH1A1GAA
SCHEMBL4176627 0.81 PIK3CD (0.68) PIK3CDATMCYP3A4ALDH1A1MGAM
SCHEMBL1886097 0.77 PIK3CD (0.64) PIK3CDATMMEN1KMT2AMGAM
SCHEMBL4443126 0.77 PIK3CD (0.52) PIK3CDATMMGAMGAASI
SCHEMBL1597713 0.76 PIK3CD (0.65) PIK3CDATMMGAMGAASI
SCHEMBL12014774 0.76 PIK3CD (0.65) PIK3CDATMMGAMGAASI
SCHEMBL4181767 0.75 ATM (0.55) PIK3CDATM
SCHEMBL1312945 0.74 PIK3CD (0.64) PIK3CDATMMGAMGAASI

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-20200048265-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. (US) 2020-02-13 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-20200048265-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES MCL1, BCL9, MALT1 PIK3CD 16/4885ATM 750/4885TSPO 1929/4885

“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.