SCHEMBL10109015

SCHEMBL10109015

COc1ccc([C@@H]2Cc3cc(OC)ccc3[C@@H]3CCCC[C@H]23)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.42
HSD17B1 P14061 2/20 0.42
MAPT P10636 1/20 0.42
RECQL P46063 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
TUBB4A P04350 1/20 0.42
TUBB P07437 1/20 0.42
TUBA3C P0DPH7 1/20 0.42
TUBA1B P68363 1/20 0.42
TUBA4A P68366 1/20 0.42
TUBB4B P68371 1/20 0.42
TUBB3 Q13509 1/20 0.42
TUBB2A Q13885 1/20 0.42
TUBB8 Q3ZCM7 1/20 0.42
TUBA3E Q6PEY2 1/20 0.42
TUBA1A Q71U36 1/20 0.42
TUBA1C Q9BQE3 1/20 0.42
TUBB6 Q9BUF5 1/20 0.42
TUBB2B Q9BVA1 1/20 0.42
TUBB1 Q9H4B7 1/20 0.42

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
SCHEMBL318184 1.00 LMNA (0.42) LMNAHSD17B1MAPTRECQLSMN1; SMN2
SCHEMBL10108827 0.89 OPRM1 (0.41) CYP19A1KDM1AMAOAMAOBCHRNA7
SCHEMBL318327 0.89 OPRM1 (0.41) CYP19A1KDM1AMAOAMAOBCHRNA7
SCHEMBL10109277 0.86 LMNA (0.44) LMNASMN1; SMN2TUBB4ATUBBTUBA3C
SCHEMBL10108857 0.86 NOS3 (0.43) CYP19A1KDM1AMAOAMAOBCHRNA7
SCHEMBL318577 0.86 NOS3 (0.43) CYP19A1KDM1AMAOAMAOBCHRNA7
SCHEMBL317900 0.83 TUBB4A (0.40) LMNAMAPTSMN1; SMN2TUBB4ATUBB
SCHEMBL10109290 0.83 TUBB4A (0.40) LMNAMAPTSMN1; SMN2TUBB4ATUBB
SCHEMBL10109298 0.82 CYP19A1 (0.42) LMNATUBB4ATUBBTUBA3CTUBA1B
SCHEMBL318189 0.82 CYP19A1 (0.42) LMNATUBB4ATUBBTUBA3CTUBA1B

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 LMNA 2755/4885HSD17B1 168/4885MAPT 224/4885

“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.