SCHEMBL12470919

SCHEMBL12470919

Oc1c(Br)cc(-c2nc3ccccc3s2)cc1Br

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 9/20 0.61
RAB9A P51151 8/20 0.61
NPC1 O15118 8/20 0.61
MAPT P10636 7/20 0.61
ALDH1A1 P00352 6/20 0.61
GLA P06280 3/20 0.61
LMNA P02545 2/20 0.61
GAA P10253 2/20 0.61
SMN1; SMN2 Q16637 5/20 0.60
TP53 P04637 3/20 0.60
HSD17B10 Q99714 3/20 0.60
NFKB1 P19838 2/20 0.60
NFKB2 Q00653 2/20 0.60
RELA Q04206 2/20 0.60
POLB P06746 1/20 0.60
HPGD P15428 4/20 0.55
KMT2A Q03164 4/20 0.55
MEN1 O00255 3/20 0.55
L3MBTL1 Q9Y468 2/20 0.55
TDP1 Q9NUW8 1/20 0.55

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
SCHEMBL27016768 0.86 SMN1; SMN2 (0.67) KDM4ERAB9ANPC1MAPTALDH1A1
SCHEMBL12471564 0.84 KDM4E (0.64) KDM4ERAB9ANPC1MAPTALDH1A1
SCHEMBL7104870 0.84 APP (0.61) KDM4ERAB9ANPC1MAPTALDH1A1
SCHEMBL13053014 0.82 RAB9A (0.69) KDM4ERAB9ANPC1MAPTALDH1A1
SCHEMBL12471067 0.81 RAB9A (0.76) KDM4ERAB9ANPC1MAPTALDH1A1
SCHEMBL21313421 0.81 KDM4E (0.59) KDM4ERAB9ANPC1MAPTALDH1A1
SCHEMBL2483239 0.81 KDM4E (0.59) KDM4ERAB9ANPC1MAPTALDH1A1
SCHEMBL25713615 0.81 RAB9A (0.76) KDM4ERAB9ANPC1MAPTALDH1A1
SCHEMBL14939305 0.81 RAB9A (0.67) KDM4ERAB9ANPC1MAPTALDH1A1
SCHEMBL11326988 0.81 RAB9A (0.61) KDM4ERAB9ANPC1MAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012108689-A2 NOVEL COMPOUND HAVING SKIN-WHITENING, ANTI-OXIDIZING AND PPAR ACTIVITIES AND MEDICAL USE THEREFOR 부산대학교 산학협력단 (KR) 2012-08-16 WO claimed
US-20150366776-A1 NOVEL COMPOUND HAVING SKIN-WHITENING, ANTI-OXIDIZING AND PPAR ACTIVITIES AND MEDICAL USE THEREOF PUSAN NAT UNIV IND COOP FOUND (KR) 2015-12-24 US disclosed
US-9155690-B2 Compound having skin-whitening, anti-oxidizing and PPAR activities and medical use thereof PUSAN NATIONAL UNIVERSITY INDUSTRY-UNIVERSITY COOPERATION FOUNDATION (KR) 2015-10-13 US disclosed
US-8889881-B2 Compound having skin-whitening, anti-oxidizing and PPAR activities and medical use therefor Pusan National University Industry —University Cooperation Foundation (KR) 2014-11-18 US disclosed
US-20140037564-A1 NOVEL COMPOUND HAVING SKIN-WHITENING, ANTI-OXIDIZING AND PPAR ACTIVITIES AND MEDICAL USE THEREFOR Pusan National University Indusrtyuniversity (KR) 2014-02-06 US disclosed
WO-2012108689-A2 NOVEL COMPOUND HAVING SKIN-WHITENING, ANTI-OXIDIZING AND PPAR ACTIVITIES AND MEDICAL USE THEREFOR 부산대학교 산학협력단 (KR) 2012-08-16 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 (2 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-20150366776-A1 NOVEL COMPOUND HAVING SKIN-WHITENING, ANTI-OXIDIZING AND PPAR ACTIVITIES AND MEDICAL USE THEREOF PPARG, PPARA, TYR KDM4E 3430/4885RAB9A 3882/4885NPC1 3522/4885
US-20140037564-A1 NOVEL COMPOUND HAVING SKIN-WHITENING, ANTI-OXIDIZING AND PPAR ACTIVITIES AND MEDICAL USE THEREFOR PPARG, PPARA, PPARD KDM4E 3588/4885RAB9A 4420/4885NPC1 3207/4885

“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.