SCHEMBL1755976

SCHEMBL1755976

Brc1ccc(OC2CCCCO2)cc1OC1CCCCO1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.41
DHFR P00374 1/20 0.40
PTPN1 P18031 4/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
KDM4C Q9H3R0 1/20 0.35
TNK2 Q07912 3/20 0.35
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
PDE4B Q07343 2/20 0.33
ACP1 P24666 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.30
ICAM1 P05362 1/20 0.30
SELE P16581 1/20 0.30

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
SCHEMBL20004827 0.90 HSD11B1 (0.41) HSD11B1DHFRPTPN1MEN1KMT2A
SCHEMBL7802721 0.86 PTPN1 (0.37) HSD11B1DHFRPTPN1KDM4CPDE4B
SCHEMBL12831493 0.84 PTPN1 (0.39) HSD11B1DHFRPTPN1MEN1KMT2A
SCHEMBL5166212 0.84 PTPN1 (0.38) HSD11B1DHFRPTPN1MEN1KMT2A
SCHEMBL2780758 0.84 L3MBTL1 (0.42) PTPN1L3MBTL1
SCHEMBL5535487 0.84 HSD11B1 (0.40) HSD11B1DHFRMEN1KMT2AKDM4C
SCHEMBL2017636 0.84 HSD11B1 (0.40) HSD11B1DHFRMEN1KMT2AKDM4C
SCHEMBL3451372 0.84 HSD11B1 (0.43) HSD11B1DHFRMEN1KMT2AKDM4C
SCHEMBL24177158 0.81 AR (0.41) HSD11B1DHFRMEN1KMT2AKDM4C
SCHEMBL2060182 0.81 DHFR (0.35) HSD11B1DHFRPTPN1MEN1KMT2A

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 26 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230142119-A1 TETRACYCLIC COMPOUND CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2023-05-11 US disclosed
US-20230142119-A1 TETRACYCLIC COMPOUND CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2023-05-11 US disclosed
US-20220306578-A1 TETRACYCLIC COMPOUND CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2022-09-29 US disclosed
EP-3613729-A1 TETRACYCLIC COMPOUNDS CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2020-02-26 EP disclosed
EP-3345903-B1 TETRACYCLIC COMPOUNDS CHUGAI PHARMACEUTICAL CO LTD (JP) 2019-10-09 EP disclosed
EP-3345903-A1 TETRACYCLIC COMPOUNDS Chugai Seiyaku Kabushiki Kaisha (JP) 2018-07-11 EP disclosed
EP-2975024-B1 TETRACYCLIC COMPOUNDS CHUGAI PHARMACEUTICAL CO LTD (JP) 2018-03-28 EP disclosed
US-20160340308-A1 TETRACYCLIC COMPOUND CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2016-11-24 US disclosed
US-20160340308-A1 TETRACYCLIC COMPOUND CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2016-11-24 US disclosed
US-9440922-B2 Tetracyclic compound CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2016-09-13 US disclosed
US-20150150845-A1 TETRACYCLIC COMPOUND CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2015-06-04 US disclosed
EP-2441753-A1 TETRACYCLIC COMPOUND Chugai Seiyaku Kabushiki Kaisha (JP) 2012-04-18 EP disclosed
US-20120083488-A1 TETRACYCLIC COMPOUND CHUGAI SEIYAKU KABUSHIKI KAISHA 2012-04-05 US disclosed
US-20120083488-A1 TETRACYCLIC COMPOUND CHUGAI SEIYAKU KABUSHIKI KAISHA 2012-04-05 US disclosed
WO-2010143664-A1 TETRACYCLIC COMPOUND 中外製薬株式会社 (JP) 2010-12-16 WO disclosed
US-7125428-B2 1,3-Dihydroxybenzene derivatives and colorants containing said compounds WELLA AG (DE) 2006-10-24 US disclosed
EP-1392673-B1 1,3-DIHYDROXYBENZENE DERIVATIVES AND COLORANTS CONTAINING SAID COMPOUNDS WELLA AG (DE) 2005-06-08 EP disclosed
EP-1392673-A2 1,3-DIHYDROXYBENZENE DERIVATIVES AND COLORANTS CONTAINING SAID COMPOUNDS Wella Aktiengesellschaft (DE) 2004-03-03 EP disclosed
US-20040016063-A1 1,3-Dihydroxybenzene derivatives and colorants containing said compounds HFC PRESTIGE INTERNATIONAL HOLDING SWITZERLAND S.A.R.L (CH) 2004-01-29 US disclosed
WO-2002096901-A2 1,3-DIHYDROXYBENZENE DERIVATIVES AND COLORANTS CONTAINING SAID COMPOUNDS WELLA AKTIENGESELLSCHAFT (DE) 2002-12-05 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 (6 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-20040016063-A1 1,3-Dihydroxybenzene derivatives and colorants containing said compounds KRT18, DSP, COL1A1 HSD11B1 1280/4885DHFR 103/4885PTPN1 3028/4885
US-20230142119-A1 TETRACYCLIC COMPOUND ALK, TTR, ACVR1 HSD11B1 1297/4885DHFR 641/4885PTPN1 558/4885
US-20120083488-A1 TETRACYCLIC COMPOUND ALK, TTR, ACVR1 HSD11B1 1297/4885DHFR 641/4885PTPN1 558/4885
US-20220306578-A1 TETRACYCLIC COMPOUND ALK, TTR, ACVR1 HSD11B1 1297/4885DHFR 641/4885PTPN1 558/4885
US-20160340308-A1 TETRACYCLIC COMPOUND ALK, TTR, ACVR1 HSD11B1 1297/4885DHFR 641/4885PTPN1 558/4885
US-20150150845-A1 TETRACYCLIC COMPOUND ALK, TTR, ACVR1 HSD11B1 1297/4885DHFR 641/4885PTPN1 558/4885

“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.