SCHEMBL5301615

SCHEMBL5301615

CCCCCCCCCCCCCCCC[N+](c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 4/20 0.53
SMN1; SMN2 Q16637 3/20 0.52
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
MAPK1 P28482 2/20 0.52
TP53 P04637 2/20 0.52
HTT P42858 3/20 0.50
MLNR O43193 1/20 0.47
NR1I2 O75469 1/20 0.47
ESR1 P03372 1/20 0.47
NR3C1 P04150 1/20 0.47
PGR P06401 1/20 0.47
ADRB2 P07550 1/20 0.47
CHRM2 P08172 1/20 0.47
ADRB1 P08588 1/20 0.47
HTR1A P08908 1/20 0.47
ADRA2A P08913 1/20 0.47
ADORA3 P0DMS8 1/20 0.47
CHRM1 P11229 1/20 0.47
DRD2 P14416 1/20 0.47

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
SCHEMBL5303389 1.00 DNM1 (0.53) DNM1SMN1; SMN2MEN1KMT2AMAPK1
SCHEMBL5295241 1.00 DNM1 (0.53) DNM1SMN1; SMN2MEN1KMT2AMAPK1
SCHEMBL5300779 1.00 DNM1 (0.53) DNM1SMN1; SMN2MEN1KMT2AMAPK1
SCHEMBL5284781 1.00 DNM1 (0.53) DNM1SMN1; SMN2MEN1KMT2AMAPK1
SCHEMBL5301676 1.00 DNM1 (0.53) DNM1SMN1; SMN2MEN1KMT2AMAPK1
SCHEMBL5293019 1.00 DNM1 (0.53) DNM1SMN1; SMN2MEN1KMT2AMAPK1
SCHEMBL5302291 1.00 DNM1 (0.53) DNM1SMN1; SMN2MEN1KMT2AMAPK1
SCHEMBL5292348 1.00 DNM1 (0.53) DNM1SMN1; SMN2MEN1KMT2AMAPK1
SCHEMBL5304172 1.00 DNM1 (0.53) DNM1SMN1; SMN2MEN1KMT2AMAPK1
SCHEMBL5302856 1.00 DNM1 (0.53) DNM1SMN1; SMN2MEN1KMT2AMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160251388-A1 SULFOXIDATION CATALYSTS AND METHODS FOR THEIR PREPARATION AND USE INDIAN INSTITUTE OF TECHNOLOGY MADRAS (IN) 2016-09-01 US disclosed
WO-2007006418-A1 IONIC-LIQUID-CONTAINING PRODUCTS FOR DYEING AND/OR BRIGHTENING KERATIN FIBRES HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2007-01-18 WO disclosed
WO-2006131234-A1 COSMETIC COMPOSITIONS COMPRISING IONIC LIQUIDS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2006-12-14 WO disclosed
US-6191192-B1 URETHRAL CATHETERS, GLOVES TOYO BOSEKI KABUSHIKI KAISHA (JP) 2001-02-20 US disclosed
EP-0887373-A2 Antibacterial polymeric moldings Toyo Boseki Kabushiki Kaisha (JP) 1998-12-30 EP disclosed
EP-0097551-B1 USE OF VANADIUM, NIOBIUM AND TANTALUM PEROXIDIC COMPLEXES AS REAGENTS AND CATALYSTS IN THE HYDROXYLATION OF AROMATIC HYDROCARBONS Institut Français du Pétrole (FR) 1986-10-15 EP disclosed
US-4529824-A Vanadium, niobium or tanatlum peroxidic complex INSTITUT FRANCAIS DU PETROLE (FR) 1985-07-16 US disclosed
EP-0097551-A1 Use of vanadium, niobium and tantalum peroxidic complexes as reagents and catalysts in the hydroxylation of aromatic hydrocarbons Institut Français du Pétrole (FR) 1984-01-04 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-20160251388-A1 SULFOXIDATION CATALYSTS AND METHODS FOR THEIR PREPARATION AND USE SMOX, TST, STS DNM1 2320/4885SMN1; SMN2 700/4885MEN1 4415/4885

“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.