SCHEMBL7915531

SCHEMBL7915531

Cc1cc2ccc3ccccc3c2[nH]1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.66
HPGD P15428 4/20 0.66
KDM4E B2RXH2 3/20 0.66
HTT P42858 1/20 0.66
SMN1; SMN2 Q16637 1/20 0.66
GAA P10253 3/20 0.55
HSD17B10 Q99714 5/20 0.53
MEN1 O00255 1/20 0.53
USP2 O75604 1/20 0.53
KMT2A Q03164 1/20 0.53
KIF11 P52732 1/20 0.47
RAB9A P51151 2/20 0.44
SIRT2 Q8IXJ6 1/20 0.44
SIRT1 Q96EB6 1/20 0.44
CYP2A6 P11509 3/20 0.44
TSHR P16473 3/20 0.44
TDP1 Q9NUW8 1/20 0.44
CYP1A2 P05177 3/20 0.43
RXFP1 Q9HBX9 2/20 0.43
HIF1A Q16665 2/20 0.43

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
Iodide SCHEMBL27218977 0.98 ALDH1A1 (0.64) ALDH1A1HPGDKDM4EHTTSMN1; SMN2
SCHEMBL16892342 0.82 KDM4E (0.48) ALDH1A1HPGDKDM4EHTTSMN1; SMN2
SCHEMBL4429156 0.79 KDM4E (0.44) ALDH1A1HPGDKDM4EHTTSMN1; SMN2
SCHEMBL15045557 0.79 CYP2A6 (0.45) ALDH1A1HPGDKDM4EHTTSMN1; SMN2
SCHEMBL15045566 0.79 ALDH1A1 (0.51) ALDH1A1HPGDKDM4EHTTSMN1; SMN2
SCHEMBL13561660 0.78 CYP1A2 (0.46) ALDH1A1HPGDKDM4EHTTSMN1; SMN2
SCHEMBL28669933 0.77 ALDH1A1 (0.55) ALDH1A1HPGDKDM4EHTTSMN1; SMN2
SCHEMBL29275406 0.75 ALDH1A1 (0.53) ALDH1A1HPGDKDM4EHTTSMN1; SMN2
SCHEMBL15045445 0.75 KEAP1 (0.47) ALDH1A1HPGDKDM4EHTTSMN1; SMN2
SCHEMBL4916031 0.75 ALDH1A1 (0.58) ALDH1A1HPGDKDM4EHTTSMN1; SMN2

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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118221659-A Fluorescent probe for detecting superoxide anions and nitrosyl peroxide ions in targeting manner of golgi, preparation method and application thereof 南华大学 2024-06-21 CN claimed
CN-118221659-A Fluorescent probe for detecting superoxide anions and nitrosyl peroxide ions in targeting manner of golgi, preparation method and application thereof 南华大学 2024-06-21 CN disclosed
US-20240158639-A1 PROCESS FOR PREPARING INDOCYANINE GREEN ICROM SRL (IT) 2024-05-16 US disclosed
EP-4314167-A1 PROCESS FOR PREPARING INDOCYANINE GREEN Icrom Srl (IT) 2024-02-07 EP disclosed
WO-2022200991-A1 PROCESS FOR PREPARING INDOCYANINE GREEN ICROM SRL (IT) 2022-09-29 WO disclosed
EP-0872903-B1 Method for making hydrogen storage alloy powder and electrode comprising the alloy powder SHINETSU CHEMICAL CO (JP) 2001-10-04 EP disclosed
US-6277519-B1 QUENCHING AN ALLOY MELT; COMMINUTION SHIN-ETSU CHEMICAL CO., LTD. (JP) 2001-08-21 US disclosed
US-6096144-A TREATING WITH ACIDIC OR ALKALINE SOLUTION OF CONJUGATED UNSATURATED COMPOUND WITH AT LEAST 5 BONDS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2000-08-01 US disclosed
US-5858571-A TREATING A PULVERIZED HYDROGEN ABSORBING ALLOY WITH A SOLUTION COMPRISING A CONJUGATED UNSATURATED COMPOUND SHIN-ETSU CHEMICAL CO., LTD. (JP) 1999-01-12 US disclosed
EP-0872903-A1 Method for making hydrogen storage alloy powder and electrode comprising the alloy powder Shin-Etsu Chemical Co., Ltd. (JP) 1998-10-21 EP disclosed
US-4758639-A Process for production of vinyl polymer SHIN-ETSU CHEMICAL CO., LTD. (JP) 1988-07-19 US disclosed
US-4757124-A Suspension or emulsion polymerizing vinyl chloride monomer or mixture of vinyl chloride with vinyl monomer copolymerizable therewith in reactor with walls coated with antiscaling compound containing dye or pigments SHIN-ETSU CHEMICAL CO., LTD. (JP) 1988-07-12 US disclosed
EP-0172427-A2 Process for production of vinyl chloride polymer Shin-Etsu Chemical Co., Ltd. (JP) 1986-02-26 EP disclosed
US-4539230-A COATING WALLS WITH A CHELATE COMPOUND SHIN-ETSU CHEMICAL CO., LTD. (JP) 1985-09-03 US disclosed
EP-0126991-A1 A method for preventing deposition of polymer scale and a coating agent therefor Shin-Etsu Chemical Co., Ltd. (JP) 1984-12-05 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-20240158639-A1 PROCESS FOR PREPARING INDOCYANINE GREEN INTS9, CA9, SCN9A ALDH1A1 385/4885HPGD 685/4885KDM4E 2681/4885

“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.