SCHEMBL31583

SCHEMBL31583

CC1=Nc2ccc3ccccc3c2C1(C)C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 1.00
KMT2A Q03164 3/20 1.00
MAPT P10636 4/20 0.46
TDP1 Q9NUW8 2/20 0.46
KDM4E B2RXH2 2/20 0.46
THRB P10828 2/20 0.46
LMNA P02545 1/20 0.46
APEX1 P27695 1/20 0.46
HTT P42858 1/20 0.46
RECQL P46063 1/20 0.46
ALDH1A1 P00352 5/20 0.41
CYP2A6 P11509 4/20 0.41
CYP1A2 P05177 4/20 0.38
TSHR P16473 3/20 0.38
HSD17B10 Q99714 5/20 0.38
HPGD P15428 3/20 0.37
HPRT1 P00492 1/20 0.35
MAPK1 P28482 2/20 0.35
HIF1A Q16665 2/20 0.35
L3MBTL1 Q9Y468 2/20 0.35

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
SCHEMBL29499501 1.00 MEN1 (1.00) MEN1KMT2AMAPTTDP1KDM4E
Hydrochloric Acid SCHEMBL22321960 0.98 MEN1 (0.97) MEN1KMT2AMAPTTDP1KDM4E
Iodide SCHEMBL22542621 0.98 MEN1 (0.97) MEN1KMT2AMAPTTDP1KDM4E
Iodide SCHEMBL29456898 0.98 MEN1 (0.97) MEN1KMT2AMAPTTDP1KDM4E
SCHEMBL18031555 0.79 MEN1 (0.66) MEN1KMT2AMAPTTDP1KDM4E
SCHEMBL12153323 0.79 MEN1 (0.65) MEN1KMT2AMAPTTDP1KDM4E
SCHEMBL14963003 0.79 MEN1 (0.65) MEN1KMT2ATDP1ALDH1A1CYP2A6
SCHEMBL21795198 0.78 MEN1 (0.64) MEN1KMT2AMAPTTDP1KDM4E
SCHEMBL10035887 0.78 MEN1 (0.64) MEN1KMT2AKDM4ELMNAALDH1A1
SCHEMBL11947486 0.78 MEN1 (0.64) MEN1KMT2AMAPTTDP1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119930585-A Preparation method of fluorescent probe for detecting viscosity of battery electrolyte 渤海大学 2025-05-06 CN claimed
US-20240358862-A1 Synthesis Method and Application of a Near-infrared Probe GGa-ICG specific binding to PSCA GUANGZHOU SHIYUN BIOTECHNOLOGY CO LTD (CN) 2024-10-31 US claimed
CN-118290398-A Water-soluble copper ion fluorescent probe based on hemicyanine and preparation and application thereof 贺州学院 2024-07-05 CN claimed
CN-118255744-A Water-soluble copper ion colorimetric fluorescent probe based on hemicyanine and preparation and application thereof 贺州学院 2024-06-28 CN claimed
US-20240158639-A1 PROCESS FOR PREPARING INDOCYANINE GREEN ICROM SRL (IT) 2024-05-16 US claimed
CN-118026913-A Fluorescent probe for quantitatively detecting concentration of hydroxyl free radicals in cells and preparation method and application thereof 南京鼓楼医院 2024-05-14 CN claimed
CN-118005620-A Synthesis and application of pH and viscosity dual-response near infrared fluorescent probe 郑州大学 2024-05-10 CN claimed
CN-117903037-A Aggregation-induced emission photosensitizer targeting mitochondria and preparation method and application thereof 湖北科技学院 2024-04-19 CN claimed
CN-115028572-B Carbazole benzo [ e ] indole hybrid compound, and preparation method and application thereof 南通大学 2024-02-20 CN claimed
EP-4314167-A1 PROCESS FOR PREPARING INDOCYANINE GREEN Icrom Srl (IT) 2024-02-07 EP claimed
CN-112939957-A Benzoindole derivative In-XY1, and synthesis method and application thereof 山西大学 2021-06-11 CN claimed
CN-109369719-B Molecular probe for alkaline phosphatase detection and preparation method and application thereof 深圳大学 2021-06-01 CN claimed
CN-112409238-A Benzoindole compound, preparation method and application thereof in detection of cysteine 山东师范大学 2021-02-26 CN claimed
CN-112341374-A Compound, preparation method and application of compound as pH ratio detection type fluorescent probe 山东师范大学 2021-02-09 CN claimed
CN-108676554-B Composite nano probe and preparation method and application thereof 郑州大学 2020-12-01 CN claimed
CN-111995621-A Benzoindole derivative for G-quadruplex RNA fluorescent probe and preparation method and application thereof 广东工业大学 2020-11-27 CN claimed
CN-108658838-B Heptamethine indocyanine-based formaldehyde fluorescent probe and preparation method and use method thereof 北京化工大学 2020-11-03 CN claimed
US-20190337896-A1 PROCESS FOR THE PREPARATION OF SODIUM 4-(2-((1E,3E,5E,7Z)-7-(1,1-DIMETHYL-3-(4-SULFONATOBUTYL)-1H-BENZO[e]INDOL-2(3H)-YLIDENE) HEPTA-1,3,5-TRIENYL)-1,1-DIMETHYL-1H-BENZO[e]INDOLIUM-3-YL) BUTANE-1-SULFONATE (INDOCYANINE GREEN) BIOPHORE INDIA PHARMACEUTICALS PVT. LTD. (IN) 2019-11-07 US claimed
US-10287436-B2 Process for the preparation of indocyanine green DISHMAN CARBOGEN AMCIS LIMITED (IN) 2019-05-14 US claimed
US-20180346728-A1 PROCESS FOR THE PREPARATION OF INDOCYANINE GREEN DISHMAN PHARMACEUTICALS AND CHEMICALS LIMITED (IN) 2018-12-06 US 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 (2 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-20190337896-A1 PROCESS FOR THE PREPARATION OF SODIUM 4-(2-((1E,3E,5E,7Z)-7-(1,1-DIMETHYL-3-(4-SULFONATOBUTYL)-1H-BENZO[e]INDOL-2(3H)-YLIDENE) HEPTA-1,3,5-TRIENYL)-1,1-DIMETHYL-1H-BENZO[e]INDOLIUM-3-YL) BUTANE-1-SULFONATE (INDOCYANINE GREEN) SULT1E1, IK, SULT1A1 MEN1 1966/4885KMT2A 4211/4885MAPT 1348/4885
US-20240158639-A1 PROCESS FOR PREPARING INDOCYANINE GREEN INTS9, CA9, SCN9A MEN1 1546/4885KMT2A 3634/4885MAPT 3974/4885

“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.