SCHEMBL10109283

SCHEMBL10109283

COc1ccc([C@@H]2Cc3c(C(N)=O)cc(OC)cc3[C@@H]3CCCC[C@H]23)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP10 Q53GL7 2/20 0.38
PARP15 Q460N3 1/20 0.38
KDM1A O60341 2/20 0.36
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
OPRK1 P41145 1/20 0.35
NPC1 O15118 1/20 0.35
CASP3 P42574 1/20 0.35
RAB9A P51151 1/20 0.35
SENP8 Q96LD8 1/20 0.35
SENP7 Q9BQF6 1/20 0.35
SENP6 Q9GZR1 1/20 0.35
PARP1 P09874 2/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
PARP2 Q9UGN5 1/20 0.35
PARP4 Q9UKK3 1/20 0.35
CHEK1 O14757 1/20 0.34

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
SCHEMBL318328 1.00 PARP10 (0.38) PARP10PARP15KDM1AMAOAMAOB
SCHEMBL10109246 0.90 SMN1; SMN2 (0.39) KDM1AMAOAMAOBMEN1KMT2A
SCHEMBL319593 0.90 SMN1; SMN2 (0.39) KDM1AMAOAMAOBMEN1KMT2A
SCHEMBL318636 0.89 KDM4E (0.40) MEN1KMT2ANPC1RAB9ACA1
SCHEMBL10109235 0.89 KDM4E (0.40) MEN1KMT2ANPC1RAB9ACA1
SCHEMBL10109252 0.89 KDM1A (0.36) KDM1AMAOAMAOBMEN1KMT2A
SCHEMBL318446 0.89 KDM1A (0.36) KDM1AMAOAMAOBMEN1KMT2A
SCHEMBL319574 0.87 KDM4E (0.40) MEN1KMT2ACA1CA2NOS3
SCHEMBL10109175 0.87 KDM4E (0.40) MEN1KMT2ACA1CA2NOS3
SCHEMBL10109225 0.82 ESR1 (0.38) KDM1AMAOAMAOBKMT2ANOS3

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-8093302-B2 Substituted tetralins as selective estrogen receptor-β agonists ELI LILLY AND COMPANY (US) 2012-01-10 US disclosed
US-20100249075-A1 SUBSTITUTED TETRALINS AS SELECTIVE ESTROGEN RECEPTOR-BETA AGONISTS ELI LILLY AND COMPANY (US) 2010-09-30 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-20100249075-A1 SUBSTITUTED TETRALINS AS SELECTIVE ESTROGEN RECEPTOR-BETA AGONISTS ESR2, ERLIN1, ESRRG PARP10 4058/4885PARP15 4452/4885KDM1A 2085/4885

“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.