SCHEMBL5093237

SCHEMBL5093237

CC/C=C/c1ccc2ccccc2n1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.58
RAB9A P51151 8/20 0.58
NPC1 O15118 7/20 0.58
LMNA P02545 6/20 0.58
PKM P14618 2/20 0.58
MAPT P10636 7/20 0.56
SMN1; SMN2 Q16637 5/20 0.56
HTT P42858 2/20 0.56
CYP1A2 P05177 1/20 0.56
CYP2C19 P33261 1/20 0.56
TP53 P04637 1/20 0.56
L3MBTL1 Q9Y468 4/20 0.51
MEN1 O00255 3/20 0.51
KMT2A Q03164 3/20 0.51
TDP1 Q9NUW8 3/20 0.51
ECE2 P0DPD6 2/20 0.51
NFKB1 P19838 1/20 0.51
NFKB2 Q00653 1/20 0.51
RELA Q04206 1/20 0.51
ALDH1A1 P00352 1/20 0.51

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
SCHEMBL5093246 1.00 KDM4E (0.58) KDM4ERAB9ANPC1LMNAPKM
SCHEMBL177539 0.82 RAB9A (0.53) KDM4ERAB9ANPC1LMNAPKM
SCHEMBL28443608 0.82 RAB9A (0.80) KDM4ERAB9ANPC1LMNAPKM
SCHEMBL22501441 0.82 KDM4E (0.50) KDM4ERAB9ANPC1LMNAPKM
SCHEMBL5099480 0.81 KDM4E (0.58) KDM4ERAB9ANPC1LMNAPKM
SCHEMBL372181 0.81 KDM4E (0.58) KDM4ERAB9ANPC1LMNAPKM
Hydrochloric Acid SCHEMBL7283431 0.80 KDM4E (0.56) KDM4ERAB9ANPC1LMNAPKM
Hydrochloric Acid SCHEMBL9872403 0.80 KDM4E (0.56) KDM4ERAB9ANPC1LMNAPKM
SCHEMBL21038093 0.79 KDM4E (0.54) KDM4ERAB9ANPC1LMNAPKM
Chimanine B SCHEMBL954132 0.79 KDM4E (0.63) KDM4ERAB9ANPC1LMNAPKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7342026-B2 Substituted quinolines for the treatment of protozoa and retrovirus co-infections INSTITUT DE RECHERCHE POUR LE DEVELOPPEMENT (FR) 2008-03-11 US disclosed
EP-1351940-B1 SUBSTITUTED QUINOLINES FOR THE TREATMENT OF PROTOZOAN AND RETROVIRUS CO-INFECTIONS INST RECH DEVELOPPEMENT IRD (FR) 2007-07-25 EP disclosed
US-7169786-B2 Isoxazoline derivatives as anti-depressants JANSSEN-CILAG S.A. (ES) 2007-01-30 US disclosed
US-7169786-B2 Isoxazoline derivatives as anti-depressants JANSSEN-CILAG S.A. (ES) 2007-01-30 US disclosed
US-20050165052-A1 Substituted quinolines for the treatment of protozoa and retrovirus co-infections INSTITUT DE RECHERCHE POUR LE DEVELOPPEMENT (FR) 2005-07-28 US disclosed
EP-1351940-A1 SUBSTITUTED QUINOLINES FOR THE TREATMENT OF PROTOZOAN AND RETROVIRUS CO-INFECTIONS Institut de Recherche pour le Développement ( IRD) (FR) 2003-10-15 EP disclosed
WO-2002057238-A1 SUBSTITUTED QUINOLINES FOR THE TREATMENT OF PROTOZOAN AND RETROVIRUS CO-INFECTIONS INSTITUT DE RECHERCHE POUR LE DEVELOPPEMENT (IRD) (FR) 2002-07-25 WO 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-20050165052-A1 Substituted quinolines for the treatment of protozoa and retrovirus co-infections C1S, C5, NSFL1C KDM4E 3607/4885RAB9A 1036/4885NPC1 242/4885

“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.