SCHEMBL8423786

SCHEMBL8423786

Oc1cc(I)ccc1-c1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.61
BACE1 P56817 2/20 0.58
ALDH1A1 P00352 2/20 0.56
HPGD P15428 2/20 0.56
BCL2L1 Q07817 1/20 0.56
HSD17B10 Q99714 1/20 0.56
ESR2 Q92731 3/20 0.45
EGFR P00533 2/20 0.42
CDK1 P06493 1/20 0.41
CDK4 P11802 1/20 0.41
CCNB1 P14635 1/20 0.41
CCND1 P24385 1/20 0.41
CDK2 P24941 1/20 0.41
HSP90AA1 P07900 1/20 0.40
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.39
MAPT P10636 1/20 0.39
MPI P34949 1/20 0.39
KMT2A Q03164 1/20 0.39
HDAC4 P56524 1/20 0.39

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
SCHEMBL5306554 0.84 BACE1 (0.62) ALOX5BACE1ALDH1A1HPGDBCL2L1
SCHEMBL13445421 0.81 BACE1 (0.44) ALOX5BACE1ALDH1A1HPGDBCL2L1
SCHEMBL18733969 0.81 ADORA2A (0.56) ALOX5BACE1ALDH1A1HPGDMEN1
SCHEMBL338655 0.80 ERN1 (0.46) ALOX5BACE1ALDH1A1HPGDHSD17B10
SCHEMBL10388224 0.79 BACE1 (0.42) ALOX5BACE1ALDH1A1HPGDBCL2L1
SCHEMBL19019376 0.78 CNR1 (0.42) ALOX5BACE1ESR2MEN1KMT2A
SCHEMBL6307069 0.77 BACE1 (0.41) ALOX5BACE1ALDH1A1HPGDBCL2L1
SCHEMBL1032857 0.77 BACE1 (0.41) ALOX5BACE1ALDH1A1HPGDBCL2L1
SCHEMBL25384655 0.77 PDCD1 (0.44) ALOX5BACE1ALDH1A1HPGDBCL2L1
SCHEMBL31087300 0.77 BACE1 (0.52) ALOX5BACE1ALDH1A1HPGDBCL2L1

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
US-10465115-B2 Cinnamic acid derivatives MERCK PATENT GMBH (DE) 2019-11-05 US disclosed
US-5985853-A β-methoxy acrylic acid derivatives, method for preparing same, and use of said derivatives as pesticides HOECHST MARION ROUSSEL (FR) 1999-11-16 US disclosed
CN-1181757-A Novel 'beta'-methoxy acrylic acid derivatives, method for preparing same, and use of said derivatives as pesticides HOECHST SCHERING AGREVO SA (FR) 1998-05-13 CN 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-10465115-B2 Cinnamic acid derivatives RCC1, LSS, C1S ALOX5 234/4885BACE1 662/4885ALDH1A1 715/4885

“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.