SCHEMBL23768073

SCHEMBL23768073

C[N+](C)=C1C=CC2=Nc3ccc(N4CCOCC4)cc3[Si](c3ccccc3)(c3ccccc3)C2=C1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 6/20 0.34
PIK3CD O00329 5/20 0.34
PIK3CB P42338 5/20 0.34
PIK3CG P48736 2/20 0.34
TMEM97 Q5BJF2 3/20 0.33
SIGMAR1 Q99720 3/20 0.33
LMNA P02545 2/20 0.33
ADRA2A P08913 2/20 0.33
ADRA2B P18089 2/20 0.33
PRKDC P78527 1/20 0.33
ADRA2C P18825 1/20 0.33
AHR P35869 1/20 0.32
MAPT P10636 3/20 0.32
ALDH1A1 P00352 3/20 0.32
KDM4E B2RXH2 1/20 0.32
NPC1 O15118 1/20 0.32
HCRTR1 O43613 1/20 0.32
GAA P10253 1/20 0.32
RAB9A P51151 1/20 0.32
DRD4 P21917 1/20 0.32

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
SCHEMBL23767794 0.90
SCHEMBL23768044 0.90 SIGMAR1 (0.34) PIK3CAPIK3CDPIK3CBPIK3CGTMEM97
SCHEMBL23768005 0.90 PIK3CD (0.33) PIK3CAPIK3CDPIK3CBPIK3CGTMEM97
SCHEMBL23767986 0.86 TDO2 (0.37) PIK3CAPIK3CDPIK3CBPIK3CGTMEM97
SCHEMBL23768009 0.85 LGMN (0.32) PIK3CAPIK3CDPIK3CBPIK3CGLMNA
SCHEMBL23768028 0.82 ALDH1A1 (0.32) PRKDCMAPTALDH1A1
SCHEMBL23768027 0.82 PDE3B (0.31) PRKDCMAPTALDH1A1
SCHEMBL23768026 0.82 LMNA (0.31) TMEM97SIGMAR1LMNAADRA2AADRA2B
SCHEMBL23767896 0.82 TMEM97 (0.33) PIK3CAPIK3CDPIK3CBPIK3CGTMEM97
SCHEMBL23768010 0.80

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-20210252152-A1 NEAR-INFRARED (NIR) ABSORBING PHOTOSENSITIZERS ORTA DOGU TEKNIK UNIVERSITESI (TR) 2021-08-19 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-20210252152-A1 NEAR-INFRARED (NIR) ABSORBING PHOTOSENSITIZERS PPIF, MT-ND2, PPOX PIK3CA 3627/4885PIK3CD 4235/4885PIK3CB 3694/4885

“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.