SCHEMBL450118

SCHEMBL450118

O=C(Oc1ccccn1)Oc1ccccn1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.46
CES1 P23141 1/20 0.46
LMNA P02545 4/20 0.45
L3MBTL1 Q9Y468 4/20 0.45
P4HTM Q9NXG6 3/20 0.45
NAPRT Q6XQN6 1/20 0.45
KDM4E B2RXH2 5/20 0.44
CCR1 P32246 2/20 0.44
CCR5 P51681 2/20 0.44
CCR8 P51685 2/20 0.44
CYP1A2 P05177 1/20 0.44
POLB P06746 1/20 0.44
METAP1 P53582 1/20 0.44
BLM P54132 1/20 0.44
HIF1A Q16665 1/20 0.44
DOHH Q9BU89 1/20 0.44
ALDH1A1 P00352 2/20 0.43
NPC1 O15118 4/20 0.42
RAB9A P51151 4/20 0.42
PKM P14618 2/20 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
SCHEMBL7521569 0.91 CES2 (0.48) CES2CES1LMNAL3MBTL1P4HTM
SCHEMBL245065 0.88 NPC1 (0.46) CES2CES1LMNAL3MBTL1P4HTM
SCHEMBL11865903 0.86 CES2 (0.46) CES2CES1LMNAL3MBTL1P4HTM
SCHEMBL28667662 0.86 CES2 (0.39) CES2CES1LMNAL3MBTL1P4HTM
SCHEMBL101751 0.84 LMNA (0.48) CES2CES1LMNAL3MBTL1P4HTM
SCHEMBL28960343 0.84 CES2 (0.45) CES2CES1LMNAL3MBTL1P4HTM
SCHEMBL3676096 0.84 CES2 (0.45) CES2CES1LMNAL3MBTL1P4HTM
SCHEMBL8893245 0.83 ELANE (0.45) CES2CES1LMNAL3MBTL1P4HTM
SCHEMBL6642658 0.83 TSHR (0.38) CES2CES1LMNAL3MBTL1P4HTM
SCHEMBL5081081 0.83 CES2 (0.37) CES2CES1LMNAL3MBTL1P4HTM

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 1246 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2026099776-A1 A PROCESS FOR THE PREPARATION OF PACLITAXEL FRESENIUS KABI ONCOLOGY LTD. (IN) 2026-05-15 WO claimed
CN-119852517-A Sodium ion battery electrolyte 中石油深圳新能源研究院有限公司 2025-04-18 CN claimed
EP-3645492-B1 PREPARATION PROCESS OF ORTHO ALKOXY BISPHENOL MONOMERS UNIV LEUVEN KATH (BE) 2024-08-21 EP claimed
CN-110809570-B Preparation method of ortho-alkoxy bisphenol monomer 鲁汶天主教大学 2023-06-23 CN claimed
CN-115515644-A Antibody-drug conjugate, preparation method and application thereof 昆山新蕴达生物科技有限公司 2022-12-23 CN claimed
US-11414519-B2 Ortho alkoxy bisphenol monomers KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2022-08-16 US claimed
CN-109988296-B Process for producing polycarbonate polyol and polycarbonate polyol composition 财团法人工业技术研究院 2021-09-10 CN claimed
CN-111082139-B Non-aqueous electrolyte and lithium ion battery 东莞东阳光科研发有限公司 2020-10-09 CN claimed
US-10689488-B2 Method for preparing polycarbonate polyol and composition comprising the polycarbonate polyol INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2020-06-23 US claimed
EP-3645492-A1 PREPARATION PROCESS OF ORTHO ALKOXY BISPHENOL MONOMERS Katholieke Universiteit Leuven (BE) 2020-05-06 EP claimed
EP-0666857-A1 METHOD FOR PREPARING TAXANE DERIVATIVES Aventis Pharma S.A. (FR) 1995-08-16 EP claimed
WO-1994018186-A1 SYNTHESIS OF TAXOL, ANALOGS AND INTERMEDIATES WITH VARIABLE A-RING SIDE CHAINS BRYN MAWR COLLEGE (US) 1994-08-18 WO claimed
EP-0599973-A1 PROCESS FOR THE PREPARATION OF BETA-PHENYLISOSERINE DERIVATIVES AND USE THEREOF Aventis Pharma S.A. (FR) 1994-06-08 EP claimed
WO-1994010169-A1 METHOD FOR PREPARING TAXANE DERIVATIVES RHONE-POULENC RORER S.A. (FR) 1994-05-11 WO claimed
US-RE34277-E Process for preparing taxol CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 1993-06-08 US claimed
WO-1993004038-A1 PROCESS FOR THE PREPARATION OF BETA-PHENYLISOSERINE DERIVATIVES AND USE THEREOF RHONE-POULENC RORER S.A. (FR) 1993-03-04 WO claimed
EP-0528729-A1 Process for the preparation of beta-phenylisoserine derivatives and their utilisation Aventis Pharma S.A. (FR) 1993-02-24 EP claimed
US-4924011-A CONDENSATION, ESTERIFICATION; ANTITUMOR AND ANITLEUKEMIA AGENTS CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 1990-05-08 US claimed
US-4924012-A Process for preparing derivatives of baccatine III and of 10-deacetyl baccatine III RHONE-POULENC SANTE (FR) 1990-05-08 US claimed
EP-0253738-B1 TAXOL DERIVATIVES, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM RHONE-POULENC SANTE (FR) 1990-01-31 EP claimed

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-11414519-B2 Ortho alkoxy bisphenol monomers ALK, ESR1, ADIPOR1 CES2 385/4885CES1 73/4885LMNA 2642/4885

“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.