SCHEMBL3098200

SCHEMBL3098200

Cc1ccc(CN2[CH]Cc3ccccc32)cc1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.47
POLB P06746 1/20 0.47
TP53 P04637 1/20 0.44
TSHR P16473 2/20 0.43
SIGMAR1 Q99720 4/20 0.41
DRD4 P21917 7/20 0.40
DRD2 P14416 5/20 0.40
ADRA1D P25100 2/20 0.40
ADRA1A P35348 2/20 0.40
ADRA1B P35368 2/20 0.40
SLC6A4 P31645 1/20 0.40
ALDH1A1 P00352 1/20 0.40
AMPD2 Q01433 1/20 0.39

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
SCHEMBL3096254 0.86 NPC1 (0.46) LMNAPOLBTP53DRD4DRD2
SCHEMBL3084210 0.82 ATM (0.44) LMNATSHRSIGMAR1SLC6A4ALDH1A1
SCHEMBL3085317 0.82 SIGMAR1 (0.51) TSHRSIGMAR1DRD4DRD2ALDH1A1
SCHEMBL3095186 0.82 DRD4 (0.44) POLBTP53DRD4DRD2ALDH1A1
SCHEMBL7835140 0.76 ALDH1A1 (0.41) LMNAPOLBTP53TSHRDRD4
SCHEMBL3098204 0.75 ALDH1A1 (0.58) LMNAPOLBTSHRSIGMAR1DRD4
SCHEMBL29116672 0.74 LMNA (0.57) LMNAPOLBTP53TSHRSIGMAR1
SCHEMBL7835294 0.73 ALDH1A1 (0.45) LMNASIGMAR1DRD4DRD2ADRA1A
SCHEMBL11784819 0.72 HDAC1 (0.61) LMNAPOLBTSHRSIGMAR1ALDH1A1
SCHEMBL29483477 0.72 HDAC1 (0.61) LMNAPOLBTSHRSIGMAR1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8207134-B2 Fused ring spiroketal derivative and use thereof as anti-diabetic drug CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2012-06-26 US disclosed
US-20100234609-A1 FUSED RING SPIROKETAL DERIVATIVE AND USE THEREOF AS ANTI-DIABETIC DRUG CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2010-09-16 US disclosed
EP-2048152-A1 FUSED RING SPIROKETAL DERIVATIVE AND USE THEREOF AS DRUG FOR TREATING DIABETES CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2009-04-15 EP 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-20100234609-A1 FUSED RING SPIROKETAL DERIVATIVE AND USE THEREOF AS ANTI-DIABETIC DRUG REN, WNK1, GCKR LMNA 2203/4885POLB 4613/4885TP53 4276/4885

“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.