SCHEMBL20354331

SCHEMBL20354331

CCCc1ccc2oc3ccccc3c2c1

nearest known ligand 0.66

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.66
CYP2D6 P10635 1/20 0.66
CYP2C19 P33261 1/20 0.66
PDE10A Q9Y233 11/20 0.54
ALDH1A1 P00352 2/20 0.50
MAPT P10636 2/20 0.50
RAB9A P51151 2/20 0.50
KDM4E B2RXH2 1/20 0.50
MEN1 O00255 1/20 0.50
NPC1 O15118 1/20 0.50
HPGD P15428 1/20 0.50
KMT2A Q03164 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
AHR P35869 1/20 0.46
PDE4D Q08499 1/20 0.44
LMNA P02545 1/20 0.42

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
SCHEMBL21510705 0.89 CYP1A2 (0.53) CYP1A2CYP2D6CYP2C19PDE10AALDH1A1
SCHEMBL21859396 0.88 CYP1A2 (0.53) CYP1A2CYP2D6CYP2C19PDE10AALDH1A1
SCHEMBL19768724 0.87 CYP1A2 (0.72) CYP1A2CYP2D6CYP2C19PDE10AALDH1A1
SCHEMBL7783535 0.87 CYP1A2 (0.51) CYP1A2CYP2D6CYP2C19PDE10AALDH1A1
SCHEMBL11727575 0.87 MAOA (0.56) CYP1A2CYP2D6CYP2C19PDE10AALDH1A1
SCHEMBL17733428 0.87 CYP1A2 (0.51) CYP1A2CYP2D6CYP2C19PDE10AALDH1A1
SCHEMBL16806183 0.85 CYP1A2 (0.66) CYP1A2CYP2D6CYP2C19PDE10AALDH1A1
SCHEMBL10238647 0.85 CYP1A2 (0.60) CYP1A2CYP2D6CYP2C19PDE10AALDH1A1
SCHEMBL31236778 0.84 CYP1A2 (0.68) CYP1A2CYP2D6CYP2C19PDE10AALDH1A1
SCHEMBL25682892 0.83 CYP1A2 (0.48) CYP1A2CYP2D6CYP2C19PDE10AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021222542-A1 5-AMINO-2-PIPERIDINON-3-YL-1-OXOISOINDOLINE DERIVATIVES FOR DEGRADATION OF IKZF2 DEGRADERS PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2021-11-04 WO disclosed
WO-2021034081-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME 솔루스첨단소재 주식회사 2021-02-25 WO disclosed
US-20180186783-A1 INHIBITORS OF PROTEIN KINASES ALEXION PHARMACEUTICALS, INC. 2018-07-05 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-20180186783-A1 INHIBITORS OF PROTEIN KINASES SYK, BTK, JAK1 CYP1A2 1714/4885CYP2D6 2539/4885CYP2C19 1044/4885

“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.