SCHEMBL16747720

SCHEMBL16747720

Cc1ccc2c(CN)c(=O)[nH]c(C)c2c1

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.45
▸ HSD17B10 Q99714 2/20 0.44
▸ MAPT P10636 2/20 0.44
▸ TSHR P16473 1/20 0.44
▸ HTT P42858 1/20 0.44
▸ PDE3B Q13370 3/20 0.43
▸ PDE3A Q14432 3/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ KDM4E B2RXH2 3/20 0.40
▸ RECQL P46063 1/20 0.40
▸ ALDH1A1 P00352 3/20 0.40
▸ PDE10A Q9Y233 2/20 0.40
▸ MEN1 O00255 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ PIM1 P11309 1/20 0.38
▸ TYMS P04818 1/20 0.37
▸ CHEK1 O14757 1/20 0.37

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
SCHEMBL16740899 0.81 LOXL2 (0.43) HSD17B10HTTPDE3BPDE3AKDM4E
Hydrochloric Acid SCHEMBL21113172 0.79 LOXL2 (0.42) HSD17B10HTTPDE3BPDE3AKDM4E
SCHEMBL16740923 0.75 PDE3B (0.74) PDE3BPDE3APDE10A
SCHEMBL16740947 0.75 HTR1D (0.49) LMNAHSD17B10PDE3BPDE3AKDM4E
Hydrochloric Acid SCHEMBL18128185 0.74 PDE3B (0.72) PDE3BPDE3APDE10A
SCHEMBL16747721 0.74 PDE3B (0.57) LMNAHSD17B10MAPTTSHRHTT
SCHEMBL16747722 0.71 LMNA (0.46) LMNAHSD17B10MAPTTSHRHTT
SCHEMBL18135122 0.70 KDM4E (0.48) LMNAMAPTTSHRPDE3BPDE3A
SCHEMBL23087662 0.66 PRMT5 (0.65) —
SCHEMBL30970768 0.66 PRMT5 (0.65) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9738630-B2 Inhibitors of lysine methyl transferase BRISTOL-MYERS SQUIBB COMPANY (US) 2017-08-22 — — US disclosed
US-9738630-B2 Inhibitors of lysine methyl transferase BRISTOL-MYERS SQUIBB COMPANY (US) 2017-08-22 — — US disclosed
US-20160297806-A1 INHIBITORS OF LYSINE METHYL TRANSFERASE BRISTOL MYERS SQUIBB CO (US) 2016-10-13 — — US disclosed
US-20160297806-A1 INHIBITORS OF LYSINE METHYL TRANSFERASE BRISTOL MYERS SQUIBB CO (US) 2016-10-13 — — US disclosed
WO-2015077193-A1 INHIBITORS OF LYSINE METHYL TRANSFERASE BRISTOL-MYERS SQUIBB COMPANY (US) 2015-05-28 — — WO 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-20160297806-A1 INHIBITORS OF LYSINE METHYL TRANSFERASE EZH2, DOT1L, EHMT1 LMNA 3571/4885HSD17B10 2976/4885MAPT 2422/4885

“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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