SCHEMBL2476987

SCHEMBL2476987

c1ccc2[nH]c(-c3c[nH]c4ccccc34)cc2c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 1/20 0.54
KDR P35968 1/20 0.54
RAB9A P51151 4/20 0.52
NPC1 O15118 2/20 0.52
AHR P35869 1/20 0.51
ALDH1A1 P00352 5/20 0.50
MAPT P10636 5/20 0.50
MEN1 O00255 5/20 0.50
KMT2A Q03164 5/20 0.50
KDM4E B2RXH2 4/20 0.50
HPGD P15428 3/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
NPSR1 Q6W5P4 2/20 0.50
ITK Q08881 1/20 0.50
PDGFRB P09619 1/20 0.49
PDGFRA P16234 1/20 0.49
LMNA P02545 2/20 0.49
CYP1A2 P05177 2/20 0.49
CYP2C9 P11712 2/20 0.49
CYP2C19 P33261 2/20 0.49

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
SCHEMBL10226019 0.85 RAB9A (0.53) CHEK1KDRRAB9ANPC1AHR
SCHEMBL17178928 0.84 ITK (0.57) CHEK1KDRRAB9ANPC1AHR
SCHEMBL18463852 0.84 ITK (0.57) RAB9ANPC1ALDH1A1MAPTMEN1
SCHEMBL11363931 0.83 KDR (0.63) CHEK1KDRRAB9ANPC1ALDH1A1
SCHEMBL10176240 0.81 KDR (0.61) CHEK1KDRRAB9ANPC1ALDH1A1
SCHEMBL17179464 0.81 KIF11 (0.50) ALDH1A1MAPTSMN1; SMN2NPSR1LMNA
SCHEMBL17179277 0.81 ITK (0.60) KDRRAB9ANPC1AHRALDH1A1
SCHEMBL15436394 0.80 CDC7 (0.50) ITKPRKD3PIM1PRKACACCNE1
SCHEMBL4725465 0.80 PDGFRB (0.55) ALDH1A1MAPTMEN1KMT2AKDM4E
SCHEMBL1748617 0.80 RIPK1 (0.57) PDGFRBPDGFRAHSD17B10PIM1CCNE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117964626-A Method for preparing indole [3,2-a ] carbazole alkaloid by taking 2, 3' -biindole as raw material 重庆医科大学 2024-05-03 CN claimed
CN-109942581-B Indoline [3,2-a ] carbazole and pyridine derivative, and preparation method, application and device thereof 武汉尚赛光电科技有限公司 2020-09-04 CN claimed
CN-117964626-A Method for preparing indole [3,2-a ] carbazole alkaloid by taking 2, 3' -biindole as raw material 重庆医科大学 2024-05-03 CN disclosed
CN-117964626-A Method for preparing indole [3,2-a ] carbazole alkaloid by taking 2, 3' -biindole as raw material 重庆医科大学 2024-05-03 CN disclosed
CN-117964626-A Method for preparing indole [3,2-a ] carbazole alkaloid by taking 2, 3' -biindole as raw material 重庆医科大学 2024-05-03 CN disclosed
CN-117903161-A Tetrathiodiindole compound and derivative, synthetic method and application thereof 衡阳师范学院 2024-04-19 CN disclosed
EP-3941920-B1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2024-03-20 EP disclosed
CN-109195970-B Electroactive material 株式会社LG 化学 2022-04-08 CN disclosed
EP-3941920-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES Merck Patent GmbH (DE) 2022-01-26 EP disclosed
CN-113292598-A Axial chiral biaryl compound with P-stereocenter and synthesis method and application thereof 陕西师范大学 2021-08-24 CN disclosed
US-20210024464-A1 BINDING FUNCTION 3 (BF3) SITE COMPOUNDS AS THERAPEUTICS AND METHODS FOR THEIR USE UNIV BRITISH COLUMBIA (CA) 2021-01-28 US disclosed
US-7351395-B1 Catalytically saturating polycyclic aromatic hydrocarbons for storage, then dehydrogenation with catalyst to release hydrogen; supplying hydrogen to fuel cells AIR PRODUCTS AND CHEMICALS, INC. (US) 2008-04-01 US disclosed
EP-0343925-B1 Dye compositions for dyeing denim cotton yarns and dyeing process and dyed articles using same MITSUI TOATSU CHEMICALS (JP) 1994-08-31 EP disclosed
US-5122160-A Denim; vat dyes; redox system MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1992-06-16 US disclosed
US-5034016-A Indirubin dyes, quinophthalone dyes for red, yellow, white or grey colors for cotton MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1991-07-23 US disclosed
EP-0431906-A2 Cotton rope-dyeing methods MITSUI TOATSU CHEMICALS, Inc. (JP) 1991-06-12 EP disclosed
EP-0343925-A2 Dye compositions for dyeing denim cotton yarns and dyeing process and dyed articles using same MITSUI TOATSU CHEMICALS, Inc. (JP) 1989-11-29 EP disclosed
EP-0095269-B1 RADIATION-SENSITIVE COMPOSITIONS OF POLYMERS CONTAINING A PI-METAL CARBONYL COMPLEX OF CONJUGATED POLYOLEFIN MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1988-02-24 EP disclosed
US-4503140-A Radiation-sensitive compositions of polymers containing a π-metal carbonyl complex of conjugated polyolefin MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1985-03-05 US disclosed
EP-0095269-A2 Radiation-sensitive compositions of polymers containing a pi-metal carbonyl complex of conjugated polyolefin MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1983-11-30 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 (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-20210024464-A1 BINDING FUNCTION 3 (BF3) SITE COMPOUNDS AS THERAPEUTICS AND METHODS FOR THEIR USE KLK3, SHBG, ACP3 CHEK1 3625/4885KDR 902/4885RAB9A 2978/4885

“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.