SCHEMBL4897624

SCHEMBL4897624

O=C(O)c1ccccc1NCCCc1ccccc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM6B O15054 3/20 0.69
KDM4C Q9H3R0 3/20 0.69
ALDH1A1 P00352 4/20 0.63
HSD17B10 Q99714 4/20 0.63
HPGD P15428 4/20 0.63
MAPT P10636 3/20 0.63
NPC1 O15118 3/20 0.63
TSHR P16473 2/20 0.63
MEN1 O00255 1/20 0.63
TRPA1 O75762 1/20 0.63
LMNA P02545 1/20 0.63
CYP1A2 P05177 1/20 0.63
CYP2C9 P11712 1/20 0.63
CDK2 P24941 1/20 0.63
MAPK1 P28482 1/20 0.63
THPO P40225 1/20 0.63
BLM P54132 1/20 0.63
PMP22 Q01453 1/20 0.63
KMT2A Q03164 1/20 0.63
HDAC6 Q9UBN7 1/20 0.63

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
SCHEMBL13199682 0.95 KDM6B (0.70) KDM6BKDM4CALDH1A1HSD17B10HPGD
SCHEMBL11499132 0.94 KDM6B (0.68) KDM6BKDM4CALDH1A1HSD17B10HPGD
Enfenamic Acid SCHEMBL25191 0.90 KDM6B (0.68) KDM6BKDM4CALDH1A1HSD17B10HPGD
Enfenamic Acid SCHEMBL10935569 0.88 KDM6B (0.66) KDM6BKDM4CALDH1A1HSD17B10HPGD
SCHEMBL28326146 0.86 NPC1 (0.54) KDM6BKDM4CALDH1A1HSD17B10HPGD
SCHEMBL9838103 0.84 KDM4E (0.66) KDM6BKDM4CALDH1A1HSD17B10HPGD
SCHEMBL8689214 0.84 ALDH1A1 (0.79) KDM6BKDM4CALDH1A1HSD17B10HPGD
SCHEMBL1665592 0.83 ALDH1A1 (0.67) KDM6BKDM4CALDH1A1HSD17B10HPGD
SCHEMBL3514128 0.82 KDM6B (0.59) KDM6BKDM4CALDH1A1HSD17B10HPGD
SCHEMBL993102 0.81 HPGD (0.65) KDM6BKDM4CALDH1A1HSD17B10HPGD

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
CN-109715146-A Eradicate the method and composition of leukaemia cell 哈佛学院校长同事会 2019-05-03 CN disclosed
US-20080103205-A1 Pesticidal compositions and methods of use VIRGINIA TECH INTELLECTUAL PROPERTIES, INC. 2008-05-01 US disclosed
WO-2007050867-A2 PESTICIDAL COMPOSITIONS AND METHODS OF USE VIRGINIA TECH INTELLECTUAL PROPERTIES, INC. (US) 2007-05-03 WO disclosed
WO-1999002190-A1 ORGAN-SPECIFIC TARGETING OF CATIONIC AMPHIPHILE/RETINOBLASTOMA ENCODING DNA COMPLEXES FOR GENE THERAPY GENZYME CORPORATION (US) 1999-01-21 WO disclosed
US-4994493-A Treatment of cerebral edema MAX-PLANCK-GESELLSCHAFT ZUR FORDERUNG DER WISSENSCHAFTEN (DE) 1991-02-19 US disclosed
EP-0210574-A2 N-substituted 5-nitro anthranilic acids, process for their preparation, their use and pharmaceutical compositions based on these compounds HOECHST AKTIENGESELLSCHAFT (DE) 1987-02-04 EP disclosed
US-4350822-A Antilipidemicpara-[aryl(alkyl or alkenyl)amino]benzoic acid derivatives AMERICAN CYANAMID COMPANY (US) 1982-09-21 US disclosed
US-4185115-A Antilipidemic para-[aryl(alkyl or alkenyl)amino]-benzoic acid derivatives AMERICAN CYANAMID COMPANY (US) 1980-01-22 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-20080103205-A1 Pesticidal compositions and methods of use SLC47A1, SLC22A8, SLC47A2 KDM6B 2982/4885KDM4C 2607/4885ALDH1A1 965/4885

“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.