SCHEMBL2961485

SCHEMBL2961485

CCC(C)c1ccc2ccccc2c1[C]1C=Cc2ccccc21

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ DNMT1 P26358 1/20 0.36
▸ TSHR P16473 2/20 0.35
▸ CES1 P23141 1/20 0.34
▸ PPARG P37231 1/20 0.32
▸ PPARA Q07869 1/20 0.32
▸ MAPT P10636 2/20 0.31
▸ ALOX5 P09917 1/20 0.30
▸ CYP1A2 P05177 1/20 0.30
▸ CYP2A6 P11509 1/20 0.30
▸ MEN1 O00255 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ RAB9A P51151 1/20 0.30
▸ KMT2A Q03164 1/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30
▸ DHFR P00374 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
SCHEMBL2959116 0.77 CES1 (0.41) DNMT1TSHRCES1MAPTCYP1A2
SCHEMBL2964164 0.76 TSHR (0.47) TSHRCES1MAPTCYP1A2MEN1
SCHEMBL2964750 0.76 TSHR (0.46) DNMT1TSHRCES1MAPTCYP1A2
SCHEMBL2967833 0.75 GPR84 (0.37) DNMT1TSHRCES1MAPTCYP1A2
SCHEMBL2958679 0.73 NCEH1 (0.36) CES1CYP1A2ALDH1A1RAB9ASMN1; SMN2
SCHEMBL6546925 0.73 TSHR (0.48) TSHRCYP1A2CYP2A6ALDH1A1RAB9A
SCHEMBL2963518 0.72 CNR1 (0.38) MAPTCYP1A2MEN1ALDH1A1RAB9A
SCHEMBL2969929 0.71 CNR1 (0.39) MAPTCYP1A2MEN1ALDH1A1RAB9A
SCHEMBL2975162 0.71 CNR1 (0.39) MAPTCYP1A2MEN1ALDH1A1RAB9A
SCHEMBL2973483 0.71 CNR1 (0.39) MAPTCYP1A2MEN1ALDH1A1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7276567-B2 Heterocyclic substituted metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2007-10-02 — — US claimed
US-7763562-B2 Heteroatom bridged metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2010-07-27 — — US disclosed
US-7276567-B2 Heterocyclic substituted metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2007-10-02 — — US disclosed
US-20070135597-A1 Heteroatom bridged metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. 2007-06-14 — — US disclosed
US-7214747-B2 Phosphorus substituted metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2007-05-08 — — US disclosed
US-7214746-B2 Phosphorus bridged metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2007-05-08 — — US disclosed
US-20050261449-A1 Heterocyclic substituted metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENT INC. 2005-11-24 — — US disclosed
US-20050239981-A1 Phosphorus bridged metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. 2005-10-27 — — US disclosed
US-20050239980-A1 Phosphorus substituted metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. 2005-10-27 — — 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 (3 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-20050239981-A1 Phosphorus bridged metallocene compounds for olefin polymerization PYM1, ZNF207, POLL DNMT1 902/4885TSHR 3182/4885CES1 4742/4885
US-20070135597-A1 Heteroatom bridged metallocene compounds for olefin polymerization AP2M1, AP1M1, PYM1 DNMT1 1501/4885TSHR 551/4885CES1 4655/4885
US-20050239980-A1 Phosphorus substituted metallocene compounds for olefin polymerization CCRL2, ARL1, OSBP2 DNMT1 2176/4885TSHR 2600/4885CES1 4681/4885

“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.

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