SCHEMBL2959837

SCHEMBL2959837

CC1=C(c2ccc(C)cc2)c2ccc(Br)cc2C1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 4/20 0.48
ESR2 Q92731 4/20 0.48
METAP1 P53582 3/20 0.40
TDP2 O95551 3/20 0.39
ALDH1A1 P00352 1/20 0.39
PGR P06401 2/20 0.37
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA4 P22748 1/20 0.35
CA6 P23280 1/20 0.35
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
NPC1 O15118 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
RAB9A P51151 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
ALKBH3 Q96Q83 1/20 0.33

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
SCHEMBL2974708 0.90 ESR1 (0.44) ESR1ESR2METAP1TDP2ALDH1A1
SCHEMBL16913075 0.87 ESR1 (0.47) ESR1ESR2METAP1TDP2PGR
SCHEMBL2959335 0.87 ESR1 (0.42) ESR1ESR2METAP1TDP2ALDH1A1
SCHEMBL2974440 0.80 NPC1 (0.42) ESR1ESR2METAP1NPC1GAA
SCHEMBL2965972 0.79 METAP1 (0.39) ESR1ESR2METAP1TDP2ALDH1A1
SCHEMBL16913152 0.78 ESR1 (0.43) ESR1ESR2METAP1TDP2MEN1
SCHEMBL2970474 0.77 TDP1 (0.39) ESR1ESR2METAP1ALDH1A1CA1
SCHEMBL2971561 0.74 METAP1 (0.47) METAP1TDP2PGRCA1CA2
SCHEMBL12536037 0.74 PGR (0.49) METAP1TDP2ALDH1A1PGRCA1
SCHEMBL2974856 0.73 PGR (0.37) METAP1TDP2ALDH1A1PGRCA1

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 ESR1 361/4885ESR2 790/4885METAP1 1352/4885

“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.