SCHEMBL23767889

SCHEMBL23767889

C[Si]1(c2ccccc2)C2=CC(=O)C=CC2=Nc2ccc(N3CCOCC3)cc21

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDO2 P48775 1/20 0.36
IDO2 Q6ZQW0 1/20 0.36
ADORA2A P29274 1/20 0.36
ADORA1 P30542 1/20 0.36
ALDH1A1 P00352 3/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
KIF11 P52732 2/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
LMNA P02545 1/20 0.35
PKM P14618 1/20 0.34
TSHR P16473 1/20 0.34
PRKDC P78527 2/20 0.34
PIK3CD O00329 1/20 0.34
PIK3CA P42336 1/20 0.34
PIK3CB P42338 1/20 0.34
PIK3CG P48736 1/20 0.34
ADRA2A P08913 1/20 0.34
ADRA2B P18089 1/20 0.34
ADRA2C P18825 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
SCHEMBL23767775 0.90 PDE3B (0.34) ADORA2AADORA1ALDH1A1SMN1; SMN2KIF11
SCHEMBL23767986 0.88 TDO2 (0.37) TDO2IDO2ADORA2AADORA1ALDH1A1
SCHEMBL23768005 0.87 PIK3CD (0.33) TDO2IDO2ALDH1A1SMN1; SMN2MEN1
SCHEMBL23768048 0.86 AHR (0.33) TDO2IDO2ALDH1A1MEN1KMT2A
SCHEMBL22972949 0.85 PRKDC (0.36) TDO2IDO2ADORA2AADORA1ALDH1A1
SCHEMBL23767940 0.85 TMEM97 (0.33) TDO2IDO2ALDH1A1SMN1; SMN2MEN1
SCHEMBL23767946 0.84 PRKDC (0.32) ALDH1A1LMNAPRKDCADRA2AADRA2B
SCHEMBL23767780 0.81 PDE3B (0.35) TDO2IDO2ADORA2AADORA1ALDH1A1
SCHEMBL23767774 0.81 PRKDC (0.34) TDO2IDO2ADORA2AADORA1ALDH1A1
SCHEMBL23767912 0.81 PRKDC (0.34) ADORA2AADORA1ALDH1A1SMN1; SMN2MEN1

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 TDO2 221/4885IDO2 786/4885ADORA2A 4084/4885

“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.