SCHEMBL4892863

SCHEMBL4892863

CC(C)(C)Cc1ccc2c(c1)Cc1cc(CC(C)(C)C)ccc1-2

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.43
TSHR P16473 2/20 0.42
ALDH1A1 P00352 2/20 0.42
ATM Q13315 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
RAB9A P51151 6/20 0.41
NPC1 O15118 4/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
TP53 P04637 1/20 0.41
MAPK1 P28482 1/20 0.41
MAPT P10636 4/20 0.38
LMNA P02545 2/20 0.38
KDM4E B2RXH2 1/20 0.38
HPGD P15428 1/20 0.38
CYP17A1 P05093 1/20 0.36
THRA P10827 1/20 0.34
THRB P10828 1/20 0.34
GPR84 Q9NQS5 1/20 0.33
HTT P42858 1/20 0.33
HSD17B1 P14061 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
SCHEMBL4895801 0.88 ESR1 (0.43) ESR1TSHRALDH1A1ATMNPSR1
SCHEMBL20280722 0.79 ESR1 (0.39) ESR1RAB9ANPC1SMN1; SMN2LMNA
SCHEMBL20280724 0.79 ESR1 (0.39) ESR1THRATHRB
SCHEMBL28240683 0.78 ESR1 (0.42) ESR1ALDH1A1RAB9ANPC1MAPT
SCHEMBL24444031 0.77 MAOA (0.37) ESR1TSHRRAB9ANPC1SMN1; SMN2
SCHEMBL4900256 0.77 CNR1 (0.50) TSHRALDH1A1ATMNPSR1RAB9A
SCHEMBL7770508 0.76 ESR1 (0.41) ESR1THRATHRB
SCHEMBL19601649 0.76 ESR1 (0.41) ESR1TSHRRAB9ANPC1SMN1; SMN2
SCHEMBL20781837 0.76 ESR1 (0.41) ESR1ALDH1A1MAPTKDM4EHPGD
SCHEMBL23060168 0.76 KMT2A (0.33) ESR1ALDH1A1RAB9AMAPTHPGD

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-8084559-B2 Ethylene-vinylcyclohexane copolymers SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-12-27 US disclosed
US-20080161514-A1 Transition Metal Complex, Process For Producing Said Transition Metal Complex, Substituent-Carrying Fluorene Compound, Process For Producing Said Fluorene Compound, Catalyst Component For Olefin Polymerization, Catalyst For Olefin Polymerization, and Process For Producing Olefin Polymer SUMITOMO CHEMICAL COMPANY, LIMTIED (JP) 2008-07-03 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 (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-20080161514-A1 Transition Metal Complex, Process For Producing Said Transition Metal Complex, Substituent-Carrying Fluorene Compound, Process For Producing Said Fluorene Compound, Catalyst Component For Olefin Polymerization, Catalyst For Olefin Polymerization, and Process For Producing Olefin Polymer AOC2, ACSL1, ACSL3 ESR1 2401/4885TSHR 3725/4885ALDH1A1 1292/4885

“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.