SCHEMBL87731

SCHEMBL87731

Nc1ccc2c(c1N)Cc1ccccc1-2

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.50
RAB9A P51151 3/20 0.50
KDM4E B2RXH2 2/20 0.50
ALDH1A1 P00352 2/20 0.50
MAPT P10636 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
LMNA P02545 1/20 0.50
HPGD P15428 1/20 0.50
PNMT P11086 1/20 0.50
PGR P06401 1/20 0.45
ACHE P22303 5/20 0.44
BCHE P06276 1/20 0.44
ADORA2A P29274 1/20 0.41
ADORA1 P30542 1/20 0.41
HTR7 P34969 2/20 0.41
HTR2B P41595 2/20 0.41
MAOA P21397 2/20 0.40
MAOB P27338 1/20 0.40
DRD2 P14416 1/20 0.38
ADRA1D P25100 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
SCHEMBL30297457 1.00 NPC1 (0.50) NPC1RAB9AKDM4EALDH1A1MAPT
Hydrochloric Acid SCHEMBL7927086 0.98 PNMT (0.49) NPC1RAB9AKDM4EALDH1A1MAPT
SCHEMBL16671743 0.84 PNMT (0.44) NPC1RAB9AKDM4EALDH1A1MAPT
SCHEMBL283174 0.82 PNMT (0.53) NPC1RAB9AKDM4EALDH1A1MAPT
SCHEMBL24896110 0.81 PNMT (0.47) NPC1RAB9AKDM4EALDH1A1MAPT
SCHEMBL19857294 0.81 ADORA2A (0.50) NPC1RAB9AKDM4EALDH1A1MAPT
SCHEMBL3763956 0.81 PNMT (0.51) NPC1RAB9AKDM4EALDH1A1MAPT
SCHEMBL3763958 0.81 PNMT (0.51) NPC1RAB9AKDM4EALDH1A1MAPT
SCHEMBL22263591 0.80 PNMT (0.57) NPC1RAB9AKDM4EALDH1A1MAPT
SCHEMBL15200751 0.79 PNMT (0.50) NPC1RAB9AKDM4EALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119500260-A Synergistic polyimide photocatalytic powder and preparation method thereof 上海晶顿科技有限公司 2025-02-25 CN claimed
CN-118441482-A Preparation method of polyimide-based photocatalytic fiber 上海大学 2024-08-06 CN claimed
CN-118320858-A Polyimide photocatalysis nanofiber and preparation method thereof 上海晶顿科技有限公司 2024-07-12 CN claimed
CN-117205965-A Polyimide photocatalytic fiber and preparation method and application thereof 上海晶顿科技有限公司 2023-12-12 CN claimed
CN-117050097-A Detectable Fe in water 3+ 、Cu 2+ Zn (zinc) 2+ Molecular sensor of ion and application 德州学院 2023-11-14 CN claimed
US-20230143643-A1 LOW DK COPPER CLAD LAMINATE COMPOSITIONS DESIGNER MOLECULES INC (US) 2023-05-11 US claimed
CN-115947928-A High-crosslinking high-temperature-resistant novolac epoxy resin and preparation method thereof 中远海运能源运输股份有限公司 2023-04-11 CN claimed
CN-113150545-B Polymer film containing nano fullerene and preparation method thereof 北京市科学技术研究院分析测试研究所(北京市理化分析测试中心) 2022-11-15 CN claimed
CN-114805333-A Bismaleimide with main chain containing oxazine and Cardo structures and preparation method thereof 大连理工大学 2022-07-29 CN claimed
US-20220204766-A1 HIGH MOLECULAR WEIGHT FLEXIBLE CURABLE POLYIMIDES DESIGNER MOLECULES, INC 2022-06-30 US claimed
US-20020098378-A1 Electroluminescent device having an organic layer including polyimide NESS CO., LTD. 2002-07-25 US claimed
US-20020082432-A1 New podophyllotoxin dimer as DNA topoisomerase II inhibitors, and a process for the preparation therefore COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH 2002-06-27 US claimed
WO-2001029095-A1 AMINE-CONTAINING GRAFT POLYMERS, A METHOD FOR MAKING SAME, AND THEIR USE EXXON CHEMICAL PATENTS INC. (US) 2001-04-26 WO claimed
EP-0317306-B1 Method of preventing polymer scale deposition KANEGAFUCHI CHEMICAL IND (JP) 1994-04-06 EP claimed
US-4970278-A QUINONE-AMINE POLYMER, SILICA SOL OR ALKYL SILICATE KANEGAFUCHI CHEMICAL INDUSTRY CO., LTD. (JP) 1990-11-13 US claimed
EP-0229878-B1 PROCESS FOR SOLIDIFYING TRITIUM FROM HTO-CONTAINING LIQUIDS KERNFORSCHUNGSZENTRUM KARLSRUHE GMBH (DE) 1989-06-07 EP claimed
EP-0317306-A2 Method of preventing polymer scale deposition Kanegafuchi Chemical Industry Co., Ltd. (JP) 1989-05-24 EP claimed
EP-0058334-B1 IMPROVED SYSTEM FOR THE DETERMINATION OF GLUCOSE IN FLUIDS MILES LABORATORIES, INC. (US) 1984-10-10 EP claimed
US-4469780-A COMBINED DEVELOPMENT AND INTENSIFICATION BATH FUJI PHOTO FILM CO., LTD. (JP) 1984-09-04 US claimed
EP-0041188-B1 INTERFERENCE-RESISTANT COMPOSITION, DEVICE, METHOD OF PREPARING IT AND METHOD FOR DETERMINING A PEROXIDATIVELY ACTIVE SUBSTANCE IN A TEST SAMPLE MILES LABORATORIES, INC. (US) 1983-03-09 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-20020082432-A1 New podophyllotoxin dimer as DNA topoisomerase II inhibitors, and a process for the preparation therefore TOP2A, TOP2B, PCNA NPC1 4318/4885RAB9A 3266/4885KDM4E 695/4885

“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.