SCHEMBL12270812

SCHEMBL12270812

CB(O)c1ccc2sc3ccc(C)cc3c2c1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ CA2 P00918 1/20 0.38
▸ LPL P06858 1/20 0.38
▸ LIPG Q9Y5X9 1/20 0.38
▸ ORAI1 Q96D31 1/20 0.38
▸ ORAI2 Q96SN7 1/20 0.38
▸ ORAI3 Q9BRQ5 1/20 0.38
▸ TRPV6 Q9H1D0 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ POLB P06746 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ IDO1 P14902 2/20 0.33
▸ PIM1 P11309 1/20 0.33
▸ PIM2 Q9P1W9 1/20 0.33
▸ BCL2L1 Q07817 1/20 0.32
▸ MCL1 Q07820 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ CYP2A6 P11509 1/20 0.32
▸ DYRK1A Q13627 1/20 0.30

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
SCHEMBL1609993 0.80 CYP2A6 (0.42) KDM4EALDH1A1POLBHPGDIDO1
SCHEMBL12270848 0.79 KIF11 (0.49) KDM4EALDH1A1POLBHPGDMAPT
SCHEMBL825667 0.76 CYP2A6 (0.39) KDM4EALDH1A1POLBHPGDIDO1
SCHEMBL22738420 0.74 CYP2A6 (0.38) CA2KDM4EALDH1A1POLBHPGD
SCHEMBL30408508 0.74 CA2 (0.41) CA2LPLLIPGKDM4EALDH1A1
SCHEMBL10068340 0.72 BCL2L1 (0.44) KDM4EALDH1A1POLBHPGDIDO1
SCHEMBL10133869 0.72 MAPT (0.40) KDM4EALDH1A1POLBHPGDIDO1
SCHEMBL257003 0.71 GPR3 (0.61) KDM4EALDH1A1POLBHPGDMAPT
SCHEMBL22738447 0.71 BCL2L1 (0.43) KDM4EALDH1A1POLBHPGDIDO1
SCHEMBL29735438 0.71 CYP2A6 (0.38) KDM4EALDH1A1POLBHPGDIDO1

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-8853424-B2 Protein cross-linking inhibitor JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2014-10-07 — — US disclosed
US-20110212919-A1 PROTEIN CROSS-LINKING INHIBITOR JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2011-09-01 — — 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-20110212919-A1 PROTEIN CROSS-LINKING INHIBITOR BAZ2B, PRMT1, BRIX1 CA2 1871/4885LPL 4172/4885LIPG 4353/4885

“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.

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