SCHEMBL29644530

SCHEMBL29644530

C#CCOc1ccc(C(=O)c2ccc(Cl)cc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 2/20 0.56
HPGD P15428 2/20 0.54
CHRNB2 P17787 1/20 0.48
CHRNB4 P30926 1/20 0.48
CHRNA3 P32297 1/20 0.48
CHRNA4 P43681 1/20 0.48
LMNA P02545 3/20 0.48
ALDH1A1 P00352 2/20 0.48
KDM4E B2RXH2 1/20 0.48
HTT P42858 1/20 0.48
NR4A2 P43354 1/20 0.47
ELANE P08246 1/20 0.47
MAPK1 P28482 2/20 0.47
SRD5A2 P31213 1/20 0.47
FABP2 P12104 1/20 0.46
PPARG P37231 1/20 0.46
PPARA Q07869 1/20 0.46
SLC22A12 Q96S37 1/20 0.46
MAOA P21397 1/20 0.46
MAOB P27338 1/20 0.46

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
SCHEMBL12517362 0.91 CYP19A1 (0.59) CYP19A1CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL26673955 0.87 CYP19A1 (0.56) CYP19A1HPGDCHRNB2CHRNB4CHRNA3
SCHEMBL2511132 0.86 CA12 (0.53) HPGDALDH1A1MAOAMAOBGSTP1
SCHEMBL11529553 0.85 GAA (0.60) CYP19A1CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL16701110 0.85 SRD5A2 (0.57) CYP19A1NR4A2MAPK1SRD5A2GSTP1
SCHEMBL12516200 0.85 CYP19A1 (0.54) CYP19A1HPGDCHRNB2CHRNB4CHRNA3
SCHEMBL12517355 0.84 CYP19A1 (0.54) CYP19A1CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL16364112 0.83 CYP19A1 (0.53) CYP19A1HPGDCHRNB2CHRNB4CHRNA3
SCHEMBL14901648 0.83 ALDH1A1 (0.53) CYP19A1HPGDCHRNB2CHRNB4CHRNA3
SCHEMBL20305297 0.82 ALDH1A1 (0.54) CYP19A1CHRNB2CHRNB4CHRNA3CHRNA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240000951-A1 GPX4 PROTEIN DEGRADATION-INDUCING COMPOUND UPPTHERA (KR) 2024-01-04 US disclosed
WO-2022119362-A1 GPX4 PROTEIN DEGRADATION-INDUCING COMPOUND (주) 업테라 2022-06-09 WO 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-20240000951-A1 GPX4 PROTEIN DEGRADATION-INDUCING COMPOUND GPX4, GPX1, CRBN CYP19A1 3112/4885HPGD 3320/4885CHRNB2 3893/4885

“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.