SCHEMBL2959760

SCHEMBL2959760

Brc1cc2c(c(-c3ccccc3)c1)CC=C2

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 1/20 0.39
AKR1C2 P52895 1/20 0.39
AKR1C1 Q04828 1/20 0.39
ALDH1A1 P00352 2/20 0.35
MAPK1 P28482 2/20 0.35
PTGDR2 Q9Y5Y4 1/20 0.33
ALOX5 P09917 1/20 0.32
BACE1 P56817 1/20 0.32
MAOB P27338 1/20 0.31
PLK4 O00444 1/20 0.30
AURKA O14965 1/20 0.30
JAK2 O60674 1/20 0.30
ROCK2 O75116 1/20 0.30
PRKD3 O94806 1/20 0.30
MAP4K4 O95819 1/20 0.30
PRKCG P05129 1/20 0.30
INSR P06213 1/20 0.30
CDK1 P06493 1/20 0.30
FES P07332 1/20 0.30
IGF1R P08069 1/20 0.30

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
SCHEMBL2966321 0.76 KDM4E (0.36) ALDH1A1MAPK1ESR2
SCHEMBL2971181 0.74 PIK3R1 (0.35) ALDH1A1
SCHEMBL2968084 0.74 KDM4E (0.35) ALDH1A1MAOBCDK5DYRK1ACLK4
SCHEMBL6912627 0.74 PRCP (0.40) ALDH1A1MAPK1
SCHEMBL2975974 0.74 CRHBP (0.46) AKR1C3AKR1C2AKR1C1ALDH1A1MAPK1
SCHEMBL2962239 0.74 ALDH1A1 (0.36) ALDH1A1MAPK1
SCHEMBL2973355 0.72 AKR1C3 (0.39) AKR1C3AKR1C2AKR1C1ALDH1A1MAPK1
SCHEMBL2973312 0.71 BIRC5 (0.32)
SCHEMBL2973856 0.70 ALDH1A1 (0.34) ALDH1A1
SCHEMBL2967432 0.70 AURKA (0.33) AURKAJAK2IGF1RFGFR1KDR

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-7763562-B2 Heteroatom bridged metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2010-07-27 US disclosed
US-20070135597-A1 Heteroatom bridged metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. 2007-06-14 US disclosed
WO-2006065809-A2 HETEROATOM BRIDGED METALLOCENE COMPOUNDS FOR OLEFIN POLYMERIZATION EXXONMOBIL CHEMICAL PATENTS INC. (US) 2006-06-22 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-20070135597-A1 Heteroatom bridged metallocene compounds for olefin polymerization AP2M1, AP1M1, PYM1 AKR1C3 3611/4885AKR1C2 3868/4885AKR1C1 4022/4885

“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.