SCHEMBL647673

SCHEMBL647673

c1ccc2c(c1)Cc1c-2ncc2ccccc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 8/20 0.50
BCHE P06276 3/20 0.50
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CA4 P22748 1/20 0.45
CA6 P23280 1/20 0.45
ADORA1 P30542 2/20 0.44
ADORA2A P29274 1/20 0.44
KDM4E B2RXH2 3/20 0.44
MEN1 O00255 1/20 0.44
NPC1 O15118 1/20 0.44
TP53 P04637 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2D6 P10635 1/20 0.44
MAPT P10636 1/20 0.44
CYP2C9 P11712 1/20 0.44
PKM P14618 1/20 0.44
TSHR P16473 1/20 0.44
MAPK1 P28482 1/20 0.44
CYP2C19 P33261 1/20 0.44

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
SCHEMBL30181084 1.00 ACHE (0.50) ACHEBCHECA1CA2CA4
Hydrochloric Acid SCHEMBL6448211 0.98 ACHE (0.49) ACHEBCHECA1CA2CA4
Hydrochloric Acid SCHEMBL645057 0.98 ACHE (0.49) ACHEBCHECA1CA2CA4
SCHEMBL11746926 0.85 DYRK1A (0.51) ACHEBCHEADORA1KDM4EMEN1
SCHEMBL15271671 0.80 KMT2A (0.38) KDM4ENPC1MAPTCYP2C19RAB9A
SCHEMBL10000550 0.79 CYP2A6 (0.40) ACHEBCHECA1CA2CA4
SCHEMBL5185079 0.76 ADORA2A (0.41) ACHEBCHEADORA1ADORA2AKDM4E
SCHEMBL10028036 0.75 MAPT (0.42) ACHECA1CA2CA4CA6
SCHEMBL10000565 0.74 CYP2A6 (0.36) ACHECA1CA2CA4CA6
SCHEMBL21292583 0.74 ACHE (0.64) ACHEBCHEADORA1ADORA2ABACE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011130677-A1 INHIBITORS OF CANCER STEM CELLS UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2011-10-20 WO claimed
US-20250074917-A1 Preparation and Uses of 7-Azaindenoisoquinolines PURDUE RESEARCH FOUNDATION 2025-03-06 US disclosed
CN-119497715-A Preparation and application of 7-aza-indeno isoquinoline 珀杜研究基金会 2025-02-21 CN disclosed
EP-4507736-A1 COMBINATION THERAPY FOR TREATING TROP-2 EXPRESSING CANCERS GILEAD SCIENCES, INC. (US) 2025-02-19 EP disclosed
US-20240287089-A1 Preparation and Uses of 7-Azaindenoisoquinolines PURDUE RESEARCH FOUNDATION (US) 2024-08-29 US disclosed
WO-2024097812-A1 THERAPY FOR TREATING BLADDER CANCER GILEAD SCIENCES, INC. (US) 2024-05-10 WO disclosed
WO-2023215238-A1 PREPARATION AND USES OF 7-AZAINDENOISOQUINOLINES PURDUE RESEARCH FOUNDATION (US) 2023-11-09 WO disclosed
WO-2023201267-A1 COMBINATION THERAPY FOR TREATING TROP-2 EXPRESSING CANCERS GILEAD SCIENCES, INC. (US) 2023-10-19 WO disclosed
EP-3480187-B1 METHOD FOR PREPARING INDENOISOQUINOLINE DERIVATIVES UNIV NAT TAIWAN NORMAL (TW) 2023-10-04 EP disclosed
US-20230219895-A1 OXYNITIDINE DERIVATIVES USEFUL AS INHIBITORS OF TOPOISOMERASE IB (TOP1) AND TYROSYL-DNA PHOSPHODIESTERASE 1 (TDP1) SHENZHEN XUHUA BIOTECH CO. LTD. (CN) 2023-07-13 US disclosed
US-20030171392-A1 Substituted indeno[1,2-c]isoquinoline derivatives and methods of use thereof INOTEK PHARMACEUTICALS CORPORATION 2003-09-11 US disclosed
EP-1335974-A2 CRYSTAL COMPOSITIONS COMPRISING TOPOISOMERASE I Emerald Biostructures Inc. (US) 2003-08-20 EP disclosed
US-20030096833-A1 Substituted ideno[1,2-c]isoquinoline derivatives and methods of use thereof INOTEK PHARMACEUTICALS CORPORATION 2003-05-22 US disclosed
US-20030096833-A1 Substituted ideno[1,2-c]isoquinoline derivatives and methods of use thereof INOTEK PHARMACEUTICALS CORPORATION 2003-05-22 US disclosed
US-20030096833-A1 Substituted ideno[1,2-c]isoquinoline derivatives and methods of use thereof INOTEK PHARMACEUTICALS CORPORATION 2003-05-22 US disclosed
WO-2003020700-A2 SUBSTITUTED INDENO[1,2-c]ISOQUINOLINE DERIVATIVES AND METHODS OF USE THEREOF INOTEK PHARMACEUTICALS CORPORATION (US) 2003-03-13 WO disclosed
WO-2003020700-A2 SUBSTITUTED INDENO[1,2-c]ISOQUINOLINE DERIVATIVES AND METHODS OF USE THEREOF INOTEK PHARMACEUTICALS CORPORATION (US) 2003-03-13 WO disclosed
WO-2002040653-A2 CHRYSTAL COMPOSITIONS COMPRISING TOPOISOMERASE I EMERALD BIOSTRUCTURES, INC. (US) 2002-05-23 WO disclosed
US-5597831-A 6-[X-(2-hydroxyethyl) aminoalkyl]-5,11-dioxo-5,6-dihydro-11-H-indeno[1,2-c]isoquinolines and their use as antineoplastic agents VUFB A.S (CS) 1997-01-28 US disclosed
EP-0643699-B1 6-(2-HYDROXYETHYLAMINOALKYL)-5,11-DIOXO-5,6-DIHYDRO-11H- INDENO[1,2-C]ISOQUINOLINES AND THEIR USE AS ANTINEOPLASTIC AGENTS VUFB AS (CZ) 1996-10-23 EP 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 (5 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-20250074917-A1 Preparation and Uses of 7-Azaindenoisoquinolines MYC, MYCBP, DNMT1 ACHE 4790/4885BCHE 4358/4885CA1 4780/4885
US-20030096833-A1 Substituted ideno[1,2-c]isoquinoline derivatives and methods of use thereof UGT1A1, XPO1, IPO7 ACHE 1046/4885BCHE 1729/4885CA1 4597/4885
US-20030171392-A1 Substituted indeno[1,2-c]isoquinoline derivatives and methods of use thereof CYP1B1, UGT1A1, CYP4B1 ACHE 522/4885BCHE 730/4885CA1 4332/4885
US-20230219895-A1 OXYNITIDINE DERIVATIVES USEFUL AS INHIBITORS OF TOPOISOMERASE IB (TOP1) AND TYROSYL-DNA PHOSPHODIESTERASE 1 (TDP1) TDP1, TOP1, TOP2A ACHE 1577/4885BCHE 1903/4885CA1 3228/4885
US-20240287089-A1 Preparation and Uses of 7-Azaindenoisoquinolines MYC, MYCBP, DNMT1 ACHE 4790/4885BCHE 4358/4885CA1 4780/4885

“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.