SCHEMBL3559655

SCHEMBL3559655

O=C(Nc1cccs1)c1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.60
KMT2A Q03164 5/20 0.60
RAB9A P51151 4/20 0.60
NPC1 O15118 3/20 0.60
GBA1 P04062 2/20 0.59
KCNK3 O14649 1/20 0.55
KCNK9 Q9NPC2 1/20 0.55
MAPT P10636 8/20 0.54
TP53 P04637 3/20 0.54
SMN1; SMN2 Q16637 3/20 0.54
NFKB1 P19838 2/20 0.54
NFKB2 Q00653 2/20 0.54
RELA Q04206 2/20 0.54
HPGD P15428 2/20 0.53
GAA P10253 7/20 0.51
HSD17B10 Q99714 6/20 0.51
ALOX15 P16050 5/20 0.51
NAMPT P43490 1/20 0.51
ALDH1A1 P00352 4/20 0.50
HTT P42858 3/20 0.50

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
SCHEMBL4683620 0.86 MEN1 (0.59) MEN1KMT2ARAB9ANPC1MAPT
SCHEMBL29684206 0.85 HDAC8 (0.57) MEN1KMT2AGBA1KCNK3KCNK9
SCHEMBL3914463 0.85 NAMPT (0.63) MEN1KMT2ARAB9ANPC1GBA1
SCHEMBL20389106 0.84 MEN1 (0.55) MEN1KMT2ARAB9ANPC1GBA1
SCHEMBL29952373 0.81 GBA1 (0.53) MEN1KMT2ARAB9ANPC1GBA1
SCHEMBL10406072 0.80 KMT2A (0.66) MEN1KMT2ARAB9AKCNK3SMN1; SMN2
SCHEMBL418428 0.79
Benzene SCHEMBL29129490 0.79 GAA (0.58) MEN1KMT2ARAB9ANPC1MAPT
SCHEMBL18825696 0.79 NAMPT (0.50) MEN1KMT2ARAB9ANPC1GBA1
SCHEMBL20379964 0.79 MAPT (0.63) MEN1KMT2ARAB9ANPC1GBA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2035386-A1 ISOQUINOLINE DERIVATIVES AND THEIR USE AS INHIBITORS OF CYTOKINE MEDIATED DISEASES AstraZeneca AB (SE) 2009-03-18 EP claimed
WO-2007149031-A1 ISOQUINOLINE DERIVATIVES AND THEIR USE AS INHIBITORS OF CYTOKINE MEDIATED DISEASES ASTRAZENECA AB (SE) 2007-12-27 WO claimed
US-5541299-A Process for the preparation of dyestuffs BAYER AKTIENGESELLSCHAFT (DE) 1996-07-30 US claimed
EP-3284481-B1 CELL DEATH INDUCING AGENT FOR CELLS HAVING BRAF GENE MUTATION, AGENT FOR INHIBITING PROLIFERATION OF SAID CELLS AND PHARMACEUTICAL COMPOSITION FOR TREATING PATIENT SUFFERING FROM EFFECTS OF ABNORMAL PROLIFERATION OF SAID CELLS NITTO DENKO CORP (JP) 2024-05-15 EP disclosed
CN-116271056-A Cell death inducing agent for cell having BRAF gene mutation, proliferation inhibiting agent for the cell, and pharmaceutical composition for treating disease caused by abnormal proliferation of the cell 日东电工株式会社 2023-06-23 CN disclosed
EP-4117703-A1 METHODS AND COMPOSITIONS FOR TREATMENT OF CORONAVIRUS INFECTION Constant Therapeutics LLC (US) 2023-01-18 EP disclosed
WO-2021183863-A1 METHODS AND COMPOSITIONS FOR TREATMENT OF CORONAVIRUS INFECTION CONSTANT THERAPEUTICS LLC (US) 2021-09-16 WO disclosed
US-10570396-B2 Cell death inducing agent for cells having BRAF gene mutation, growth suppressing agent for same cells and pharmaceutical composition for therapy of diseases caused by growth defect of same cells NITTO DENKO CORPORATION (JP) 2020-02-25 US disclosed
EP-3373951-A1 METHODS AND COMPOSITIONS FOR THE TREATMENT OF EPIDERMOLYSIS BULLOSA Tarix Pharmaceuticals Ltd. (US) 2018-09-19 EP disclosed
US-20180135058-A1 CELL DEATH INDUCING AGENT FOR CELLS HAVING BRAF GENE MUTATION, GROWTH SUPPRESSING AGENT FOR SAME CELLS AND PHARMACEUTICAL COMPOSITION FOR THERAPY OF DISEASES CAUSED BY GROWTH DEFECT OF SAME CELLS NITTO DENKO CORPORATION (JP) 2018-05-17 US disclosed
CN-105949161-B A kind of preparation method of 3- aromatic thiohydroxies chromocor compound 温州大学 2018-05-15 CN disclosed
WO-2013090833-A1 ANGIOTENSINS FOR TREATMENT OF FIBROSIS TARIX PHARMACEUTICALS LTD. (US) 2013-06-20 WO disclosed
US-7838676-B2 Beta-secretase modulators and methods of use AMGEN INC. (US) 2010-11-23 US disclosed
US-20080119457-A1 Benzene, Pyridine, and Pyridazine Derivatives SERENEX, INC. 2008-05-22 US disclosed
WO-2008024978-A2 TETRAHYDROINDOLONE AND TETRAHYDROINDAZOLONE DERIVATIVES SERENEX, INC. (US) 2008-02-28 WO disclosed
US-5578711-A Process for the preparation of dyestuffs BAYER AKTIENGESELLSCHAFT (DE) 1996-11-26 US disclosed
US-5541299-A Process for the preparation of dyestuffs BAYER AKTIENGESELLSCHAFT (DE) 1996-07-30 US disclosed
US-5502171-A Process for the preparation of dyestuffs BAYER AKTIENGESELLSCHAFT (DE) 1996-03-26 US disclosed
US-4199360-A DISSOLVING METHINE DYE IN PRESENCE OF RED SHIFT COMPOUND FUJI PHOTO FILM CO., LTD. (JP) 1980-04-22 US disclosed
US-4138266-A SULFO-SUBSTITUTED CYANINE AND RED SHIFT TRIAZOLE DYES FUJI PHOTO FILM CO., LTD. (JP) 1979-02-06 US 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-20080119457-A1 Benzene, Pyridine, and Pyridazine Derivatives MKI67, CCNB1, RB1 MEN1 2752/4885KMT2A 3463/4885RAB9A 3769/4885

“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.