SCHEMBL3142579

SCHEMBL3142579

Cc1cc(N2CCC(CC(=O)N3CCN(Cc4ccc5c(c4)OCO5)CC3)CC2)ccc1Oc1ccc(NS(=O)(=O)c2ccc(C(F)(F)F)cc2)cn1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 10/20 0.47
SMN1; SMN2 Q16637 8/20 0.47
ALDH1A1 P00352 5/20 0.47
USP2 O75604 2/20 0.43
PKM P14618 1/20 0.43
HTT P42858 4/20 0.43
HSD17B10 Q99714 1/20 0.43
POLB P06746 3/20 0.42
RAB9A P51151 2/20 0.42
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
KDM4E B2RXH2 1/20 0.40
NPC1 O15118 1/20 0.40
MAPT P10636 1/20 0.40
TSHR P16473 1/20 0.39
PPARD Q03181 1/20 0.38
PPARA Q07869 1/20 0.38
GAA P10253 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
FAAH O00519 1/20 0.38

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
SCHEMBL3142589 0.97 LMNA (0.47) LMNASMN1; SMN2ALDH1A1USP2PKM
SCHEMBL3026272 0.90 ABCB1 (0.43) LMNASMN1; SMN2ALDH1A1USP2HTT
SCHEMBL3027481 0.84 ABCB1 (0.48) LMNASMN1; SMN2ALDH1A1USP2HTT
SCHEMBL3133427 0.81 SMN1; SMN2 (0.46) LMNASMN1; SMN2ALDH1A1USP2PKM
SCHEMBL3033606 0.81 CYP3A4 (0.43) LMNASMN1; SMN2ALDH1A1USP2HTT
SCHEMBL3036162 0.81 MEN1 (0.46) LMNASMN1; SMN2ALDH1A1USP2HTT
SCHEMBL3133508 0.81 LMNA (0.48) LMNASMN1; SMN2ALDH1A1USP2PKM
SCHEMBL3135150 0.80 LMNA (0.46) LMNASMN1; SMN2ALDH1A1USP2PKM
SCHEMBL3026304 0.79 HIF1A (0.48) LMNASMN1; SMN2ALDH1A1USP2HSD17B10
SCHEMBL12315676 0.77 TDP1 (0.54) LMNASMN1; SMN2ALDH1A1HTTHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1957073-B1 MEDICINAL DRUG OTSUKA PHARMA CO LTD (JP) 2014-04-23 EP disclosed
US-20120238750-A1 AROMATIC COMPOUND OTSUKA PHARMACEUTICAL CO., LTD. 2012-09-20 US disclosed
US-8236826-B2 Diarylether derivatives as antitumor agents OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2012-08-07 US disclosed
US-8188277-B2 Aromatic compounds for suppressing the generation of collagen OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2012-05-29 US disclosed
US-20100004438-A1 DIARYLETHER DERIVATIVES AS ANTITUMOR AGENTS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2010-01-07 US disclosed
EP-1957073-A2 MEDICINAL DRUG OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2008-08-20 EP disclosed
US-20070270422-A1 Aromatic Compounds OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-11-22 US disclosed
WO-2007066784-A2 DIARYLETHER DERIVATIVES AS ANTITUMOR AGENTS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-06-14 WO disclosed
EP-1773797-A2 AROMATIC COMPOUNDS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-04-18 EP disclosed
WO-2006014012-A2 AROMATIC COMPOUNDS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2006-02-09 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 (3 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-20120238750-A1 AROMATIC COMPOUND CBR1, CBR3, CYP1A1 LMNA 2721/4885SMN1; SMN2 4313/4885ALDH1A1 565/4885
US-20100004438-A1 DIARYLETHER DERIVATIVES AS ANTITUMOR AGENTS ROS1, CBR1, CBR3 LMNA 4340/4885SMN1; SMN2 3224/4885ALDH1A1 265/4885
US-20070270422-A1 Aromatic Compounds COL1A1, COL2A1, COL14A1 LMNA 1091/4885SMN1; SMN2 3077/4885ALDH1A1 475/4885

“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.