SCHEMBL15908335

SCHEMBL15908335

C=CCCC1(O)c2ccccc2CCc2ccccc21

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.54
CYP2D6 P10635 1/20 0.45
SIGMAR1 Q99720 4/20 0.43
MAPK1 P28482 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
CHRM2 P08172 2/20 0.35
CHRM4 P08173 1/20 0.35
CHRM5 P08912 1/20 0.35
CHRM1 P11229 1/20 0.35
CHRM3 P20309 1/20 0.35
ADRA2A P08913 1/20 0.35
HTR2A P28223 1/20 0.34
BRD4 O60885 1/20 0.32
KIF11 P52732 1/20 0.32

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
SCHEMBL10952661 0.82 LMNA (0.49) LMNACYP2D6SIGMAR1MAPK1SMN1; SMN2
SCHEMBL29161778 0.80 PDK2 (0.39) LMNABRD4
SCHEMBL8253828 0.78 LMNA (0.60) LMNACYP2D6SIGMAR1MAPK1SMN1; SMN2
Hydrochloric Acid SCHEMBL9197586 0.78 SIGMAR1 (0.45) LMNASIGMAR1HTR2AKIF11
SCHEMBL8255088 0.77 LMNA (0.58) LMNACYP2D6SIGMAR1MAPK1SMN1; SMN2
SCHEMBL18595733 0.77 LMNA (0.58) LMNACYP2D6SIGMAR1MAPK1SMN1; SMN2
SCHEMBL19505650 0.77 LMNA (0.63) LMNACYP2D6SIGMAR1MAPK1SMN1; SMN2
SCHEMBL9198384 0.76 CCR1 (0.43) LMNASIGMAR1HTR2A
SCHEMBL6881962 0.75 LMNA (0.66) LMNACYP2D6MAPK1SMN1; SMN2CHRM2
SCHEMBL8256736 0.72 LMNA (0.53) LMNACYP2D6MAPK1SMN1; SMN2CHRM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9540358-B2 Tricyclic compounds as anticancer agents ICAHN SCHOOL OF MEDICINE AT MOUNT SINAI (US) 2017-01-10 US disclosed
US-9540358-B2 Tricyclic compounds as anticancer agents ICAHN SCHOOL OF MEDICINE AT MOUNT SINAI (US) 2017-01-10 US disclosed
US-20140213578-A1 TRICYCLIC COMPOUNDS AS ANTICANCER AGENTS MT. SINAI SCHOOL OF MEDICINE (US) 2014-07-31 US disclosed
US-20140213578-A1 TRICYCLIC COMPOUNDS AS ANTICANCER AGENTS MT. SINAI SCHOOL OF MEDICINE (US) 2014-07-31 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-20140213578-A1 TRICYCLIC COMPOUNDS AS ANTICANCER AGENTS TFEB, FOXO3, FOXO1 LMNA 4094/4885CYP2D6 3045/4885SIGMAR1 3567/4885

“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.