SCHEMBL13299331

SCHEMBL13299331

COc1ccc(-c2nc(-c3ccccc3C)nc(-c3ccccc3O)n2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 1/20 0.57
NPC1 O15118 5/20 0.51
RAB9A P51151 4/20 0.51
TSHR P16473 4/20 0.50
ALOX15 P16050 2/20 0.50
ADORA3 P0DMS8 1/20 0.50
ADORA2A P29274 1/20 0.50
ADORA2B P29275 1/20 0.50
ADORA1 P30542 1/20 0.50
MAPT P10636 6/20 0.49
MEN1 O00255 4/20 0.49
KMT2A Q03164 4/20 0.49
ATM Q13315 1/20 0.49
LMNA P02545 4/20 0.48
NFKB1 P19838 3/20 0.48
NFKB2 Q00653 3/20 0.48
RELA Q04206 3/20 0.48
KDM4E B2RXH2 3/20 0.48
ALOX12 P18054 2/20 0.48
HPGD P15428 3/20 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
SCHEMBL6512448 0.93 NPC1 (0.57) NR1H4NPC1RAB9ATSHRALOX15
SCHEMBL15909996 0.93 NPC1 (0.57) NR1H4NPC1RAB9ATSHRALOX15
SCHEMBL16746693 0.93 NPC1 (0.57) NR1H4NPC1RAB9ATSHRALOX15
SCHEMBL13299328 0.90 MAPT (0.56) NR1H4NPC1RAB9ATSHRALOX15
SCHEMBL15908123 0.90 MAPT (0.56) NR1H4NPC1RAB9ATSHRALOX15
SCHEMBL39029 0.90 ALOX15 (0.62) NR1H4NPC1RAB9ATSHRALOX15
SCHEMBL29364346 0.90 ALOX15 (0.62) NR1H4NPC1RAB9ATSHRALOX15
SCHEMBL4027746 0.88 ALOX15 (0.60) NR1H4NPC1RAB9ATSHRALOX15
SCHEMBL13938597 0.87 ALOX15 (0.59) NPC1RAB9ATSHRALOX15ADORA3
SCHEMBL12216379 0.86 NPC1 (0.51) NPC1RAB9ATSHRALOX15ADORA3

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
US-9669243-B2 Delivery of hydrophobic benefit agents from bodywashes and the like onto a keratinous substrate BASF SE (DE) 2017-06-06 US disclosed
US-20100135936-A1 Delivery of hydrophobic benefit agents from bodywashes and the like onto a keratinous substrate BASF SE (DE) 2010-06-03 US disclosed
US-20080274069-A1 Cosmetic Preparations Containing Copolymers of Ethyl Methacrylate and at Least One Monoethylenically Unsaturated Carboxylic Acid BASF AKTIENGESELLSCHAFT (DE) 2008-11-06 US disclosed
US-20080247976-A1 water-resistant cosmetic or dermatological compositions for the UV-photoprotection of human skin and/or hair with enhanced stability to water DUEVA-KOGANOV OLGA V 2008-10-09 US disclosed
US-20080247975-A1 Sunscreen and personal care compositions comprising a select copolymer CIBA CORP. 2008-10-09 US disclosed
US-20080019929-A1 Micro-Particulate Organic Uv Absorber Composition CIBA SPECIALTY CHEMICALS CORP. 2008-01-24 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 (5 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-20080247976-A1 water-resistant cosmetic or dermatological compositions for the UV-photoprotection of human skin and/or hair with enhanced stability to water CUTA, POLR1C, MSH6 NR1H4 4209/4885NPC1 4533/4885RAB9A 4413/4885
US-20080274069-A1 Cosmetic Preparations Containing Copolymers of Ethyl Methacrylate and at Least One Monoethylenically Unsaturated Carboxylic Acid MCCC2, MMAB, ELOVL3 NR1H4 4364/4885NPC1 2471/4885RAB9A 2485/4885
US-20080247975-A1 Sunscreen and personal care compositions comprising a select copolymer MSH6, CUTA, ERCC5 NR1H4 4060/4885NPC1 3891/4885RAB9A 3337/4885
US-20100135936-A1 Delivery of hydrophobic benefit agents from bodywashes and the like onto a keratinous substrate KRT18, ABHD16A, CUTA NR1H4 560/4885NPC1 2885/4885RAB9A 4122/4885
US-20080019929-A1 Micro-Particulate Organic Uv Absorber Composition PCNA, FASN, CCNO NR1H4 737/4885NPC1 413/4885RAB9A 4405/4885

“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.