SCHEMBL7048451

SCHEMBL7048451

CC(Sc1ccc(Br)cc1)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
PPARA Q07869 2/20 0.48
HTT P42858 1/20 0.48
KDM4E B2RXH2 2/20 0.46
LMNA P02545 1/20 0.46
SDCBP O00560 1/20 0.44
SDC2 P34741 1/20 0.44
HSD17B10 Q99714 2/20 0.44
ALDH1A1 P00352 2/20 0.44
EPHX1 P07099 1/20 0.42
LDHA P00338 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
HPGD P15428 2/20 0.40
MAP2K7 O14733 1/20 0.40
ELANE P08246 1/20 0.40
CDC25A P30304 1/20 0.40
CDC25B P30305 1/20 0.40
TSHR P16473 1/20 0.40

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
SCHEMBL11605717 0.82 TSHR (0.42) MEN1KMT2ALMNASDCBPSDC2
SCHEMBL11574943 0.82 HPGD (0.57) MEN1KMT2APPARAKDM4ELMNA
SCHEMBL5110593 0.82 GAA (0.53) MEN1KMT2AHTTKDM4ELMNA
SCHEMBL10455022 0.82 KDM4E (0.47) HTTKDM4ELMNAHSD17B10ALDH1A1
SCHEMBL10455020 0.82 KDM4E (0.47) HTTKDM4ELMNAHSD17B10ALDH1A1
SCHEMBL1931354 0.81 KDM4E (0.51) KDM4ELMNAHSD17B10ALDH1A1EPHX1
SCHEMBL28187258 0.81 MEN1 (0.49) MEN1KMT2APPARAHTTKDM4E
SCHEMBL7398296 0.80 CYP2C9 (0.66) PPARAHTTKDM4ELMNASDCBP
SCHEMBL875038 0.80 KDM4E (0.46) HTTKDM4ELMNAHSD17B10ALDH1A1
SCHEMBL16334438 0.79 ALDH1A1 (0.46) MEN1KMT2AKDM4EALDH1A1EPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2221296-B1 FUSED INDANE COMPOUND ASTELLAS PHARMA INC (JP) 2012-09-05 EP disclosed
US-8211907-B2 Fused indane compound ASTELLAS PHARMA INC. (JP) 2012-07-03 US disclosed
US-8211907-B2 Fused indane compound ASTELLAS PHARMA INC. (JP) 2012-07-03 US disclosed
US-20100267695-A1 FUSED INDANE COMPOUND ASTELLAS PHARMA INC. (JP) 2010-10-21 US disclosed
US-20100267695-A1 FUSED INDANE COMPOUND ASTELLAS PHARMA INC. (JP) 2010-10-21 US disclosed
EP-0874808-B1 BIPHENYL HYDROXAMATE INHIBITORS OF MATRIX METALLOPROTEINASES ABBOTT LAB (US) 2003-04-09 EP disclosed
EP-0970046-A1 N-HYDROXY-2-(ALKYL, ARYL, OR HETEROARYL SULFANYL, SULFINYL OR SULFONYL)-3-SUBSTITUTED ALKYL, ARYL OR HETEROARYLAMIDES AS MATRIX METALLOPROTEINASE INHIBITORS American Cyanamid Company (US) 2000-01-12 EP disclosed
EP-0874808-A1 BIPHENYL HYDROXAMATE INHIBITORS OF MATRIX METALLOPROTEINASES Abbott Laboratories (US) 1998-11-04 EP disclosed
WO-1998038163-A1 N-HYDROXY-2-(ALKYL, ARYL, OR HETEROARYL SULFANYL, SULFINYL OR SULFONYL)-3-SUBSTITUTED ALKYL, ARYL OR HETEROARYLAMIDES AS MATRIX METALLOPROTEINASE INHIBITORS AMERICAN CYANAMID COMPANY (US) 1998-09-03 WO disclosed
US-5665777-A ANTIINFLAMMATORY AGENTS ABBOTT LABORATORIES (US) 1997-09-09 US disclosed
WO-1997018188-A1 BIPHENYL HYDROXAMATE INHIBITORS OF MATRIX METALLOPROTEINASES ABBOTT LABORATORIES (US) 1997-05-22 WO disclosed
US-4156011-A TREATMENT OF CARDIOVASCULAR DISORDERS SOCIETE ANONYME DITE: LABORATOIRE L. LAFON (FR) 1979-05-22 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-20100267695-A1 FUSED INDANE COMPOUND GRIN2A, GRIN2C, GRIN1 MEN1 1227/4885KMT2A 1160/4885PPARA 3384/4885

“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.