SCHEMBL22930626

SCHEMBL22930626

Cc1ccc2c(c1)C1(c3ccccc3C3(c4ccccc4-c4ccccc43)c3ccccc31)c1ccc3c(sc4ccccc43)c1-2

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 3/20 0.36
ALOX5 P09917 1/20 0.34
MAPT P10636 4/20 0.34
PRKDC P78527 3/20 0.34
PARP14 Q460N5 1/20 0.33
RAB9A P51151 3/20 0.32
ALDH1A1 P00352 3/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
KDM4E B2RXH2 2/20 0.32
ATM Q13315 1/20 0.32
SMN1; SMN2 Q16637 2/20 0.31
MEN1 O00255 1/20 0.31
NPC1 O15118 1/20 0.31
KMT2A Q03164 1/20 0.31
GPR3 P46089 1/20 0.30
LMNA P02545 1/20 0.30
GAA P10253 1/20 0.30
HTT P42858 1/20 0.30
HPGD P15428 1/20 0.30

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
SCHEMBL22930627 0.89 ALOX5 (0.38) ALOX5MAPTPRKDCPARP14RAB9A
SCHEMBL16170131 0.88 ALOX5 (0.36) PDK2ALOX5MAPTPRKDCPARP14
SCHEMBL16250106 0.87 GPR3 (0.39) ALOX5MAPTPRKDCPARP14RAB9A
SCHEMBL19394520 0.86 PRKDC (0.31) ALOX5MAPTPRKDCRAB9AALDH1A1
SCHEMBL18731722 0.86 PDK2 (0.36) PDK2ALOX5MAPTPRKDCPARP14
SCHEMBL16232650 0.85 PDK2 (0.31) PDK2ALOX5PRKDC
SCHEMBL16232591 0.85 PDK2 (0.31) PDK2ALOX5PRKDC
SCHEMBL19760335 0.85 ALDH1A1 (0.34) ALOX5MAPTPRKDCPARP14RAB9A
SCHEMBL19760337 0.85 ALDH1A1 (0.34) ALOX5MAPTPRKDCPARP14RAB9A
SCHEMBL16170164 0.85 ALOX5 (0.36) PDK2ALOX5MAPTPRKDC

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-10910567-B2 Double spiro-type compound and organic light emitting diode comprising same LG CHEM, LTD. 2021-02-02 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-10910567-B2 Double spiro-type compound and organic light emitting diode comprising same NR2E3, ALDH1A2, CRY1 PDK2 560/4885ALOX5 2498/4885MAPT 1561/4885

“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.