SCHEMBL7989327

SCHEMBL7989327

CCn1c(-c2ccc(N)cc2F)nnc1C(C)(C)Oc1ccc(F)cc1

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.32
GRM5 P41594 2/20 0.31
KDM4E B2RXH2 1/20 0.31
RAD52 P43351 1/20 0.31
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL7985259 0.89 HSD11B1 (0.38)
SCHEMBL7988318 0.87 RORC (0.40)
SCHEMBL7982385 0.87 KIT (0.31) KDM4ERAD52
SCHEMBL7992163 0.85 ACSS2 (0.43) MAOBMEN1ALDH1A1MAPTHPGD
SCHEMBL12671319 0.84 GRM5 (0.36) GRM5
SCHEMBL7979824 0.84 KDM4E (0.38) MAOBKDM4EMEN1ALDH1A1MAPT
SCHEMBL7978690 0.83 HSD11B1 (0.36) KDM4ERAD52
SCHEMBL7992173 0.81 HSD11B1 (0.40)
SCHEMBL7982146 0.81 CYP11B1 (0.32) MEN1ALDH1A1KMT2A
SCHEMBL7980163 0.80 P2RX7 (0.36)

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 MAOB 1184/4885GRM5 733/4885KDM4E 3912/4885

“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.