SCHEMBL7977877

SCHEMBL7977877

Cn1cc(C(=O)NC2CC2)c(Cl)n1

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.57
TSHR P16473 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.56
HPGD P15428 3/20 0.45
P2RX7 Q99572 1/20 0.45
KDM4E B2RXH2 1/20 0.45
ALPL P05186 1/20 0.45
NR3C1 P04150 2/20 0.44
CRHR1 P34998 4/20 0.43
LIPG Q9Y5X9 1/20 0.43
ALDH1A1 P00352 1/20 0.43
SMYD3 Q9H7B4 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
SCHEMBL31612706 0.78 CRHR1 (0.41) LMNATSHRSMN1; SMN2CRHR1LIPG
SCHEMBL27749280 0.78 LMNA (0.41) LMNATSHRSMN1; SMN2KDM4EALDH1A1
SCHEMBL7979529 0.78 GAA (0.46) LMNATSHRSMN1; SMN2ALDH1A1
SCHEMBL7521251 0.76 LMNA (0.58) LMNATSHRSMN1; SMN2HPGDKDM4E
SCHEMBL24583509 0.76 NPC1 (0.37) LMNATSHRSMN1; SMN2HPGDP2RX7
SCHEMBL29696803 0.76 CRHR1 (0.41) LMNATSHRSMN1; SMN2CRHR1
SCHEMBL25216336 0.76 CRHR1 (0.41) LMNATSHRSMN1; SMN2CRHR1
SCHEMBL29696783 0.76 NPC1 (0.37) LMNATSHRSMN1; SMN2HPGDP2RX7
SCHEMBL24583789 0.76 TTK (0.39) LMNATSHRSMN1; SMN2HPGDP2RX7
SCHEMBL24582705 0.74 LMNA (0.51) LMNATSHRSMN1; SMN2CRHR1ALDH1A1

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-8377923-B2 Triazole derivative or salt thereof ASTELLAS PHARMA INC. (JP) 2013-02-19 US disclosed
US-20110105460-A1 TRIAZOLE DERIVATIVE OR SALT THEREOF ASTELLAS PHARMA INC. (JP) 2011-05-05 US disclosed
WO-2010001946-A1 TRIAZOLE DERIVATIVE OR SALT THEREOF アステラス製薬株式会社 (JP) 2010-01-07 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-20110105460-A1 TRIAZOLE DERIVATIVE OR SALT THEREOF HSD11B1, HSD11B2, HSD3B1 LMNA 4210/4885TSHR 690/4885SMN1; SMN2 3061/4885

“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.