SCHEMBL16857585

SCHEMBL16857585

Cc1nn(-c2ccccc2O)c(C)c1C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.56
POLB P06746 4/20 0.50
CYP1A2 P05177 2/20 0.50
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50
ALKBH1 Q13686 1/20 0.49
PDE4B Q07343 1/20 0.49
MAPT P10636 3/20 0.47
RAB9A P51151 3/20 0.47
NPSR1 Q6W5P4 1/20 0.47
PDE4D Q08499 1/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
ALDH1A1 P00352 1/20 0.45
CYP2D6 P10635 1/20 0.45
HPGD P15428 1/20 0.45
HIF1A Q16665 1/20 0.45
HSD17B10 Q99714 1/20 0.45
NPC1 O15118 2/20 0.44
TSHR P16473 1/20 0.43

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
SCHEMBL20604195 0.83 WNT3A (0.58) LMNAPOLBCYP1A2CYP2C9CYP2C19
SCHEMBL21068095 0.83 LMNA (0.70) LMNAPOLBCYP1A2CYP2C9CYP2C19
Bicarbonate SCHEMBL17255690 0.83 ALDH1A1 (0.46) LMNAPOLBCYP1A2CYP2C9CYP2C19
SCHEMBL17255673 0.81 PDE4B (0.74) PDE4BMAPTRAB9ANPSR1PDE4D
SCHEMBL27993086 0.81 LMNA (0.52) LMNAPOLBCYP1A2CYP2C9CYP2C19
SCHEMBL2938583 0.80 MEN1 (0.69) POLBCYP1A2CYP2C9CYP2C19MAPT
SCHEMBL28102000 0.78 HSD17B10 (0.51) LMNAPOLBCYP1A2PDE4BRAB9A
SCHEMBL20604103 0.77 LMNA (0.58) LMNAPOLBCYP1A2CYP2C9CYP2C19
SCHEMBL16857586 0.76 NPC1 (0.71) LMNAMAPTRAB9ANPSR1MEN1
SCHEMBL15072219 0.76 PTGDR2 (0.59) LMNAPOLBCYP1A2CYP2C9CYP2C19

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
EP-2669274-B1 TOPICAL ANTIFUNGAL AGENT MEIJI SEIKA PHARMA CO LTD (JP) 2015-11-18 EP claimed
CN-103339112-B Topical antifungal agents MEIJI SEIKA PHARMA CO.,LTD. (JP) 2015-08-12 CN claimed
CN-103339112-A Topical antifungal agent MEIJI SEIKA PHARMA CO LTD 2013-10-02 CN claimed
CN-103339112-B Topical antifungal agents MEIJI SEIKA PHARMA CO.,LTD. (JP) 2015-08-12 CN disclosed
EP-2889031-A1 ANTITRICHOPHYTOSIS SOLUTION FOR EXTERNAL USE Meiji Seika Pharma Co., Ltd. (JP) 2015-07-01 EP disclosed
CN-104661661-A External liquid preparation for resisting trichophytosis MEIJI SEIKA PHARMA CO LTD 2015-05-27 CN disclosed
CN-103339112-A Topical antifungal agent MEIJI SEIKA PHARMA CO LTD 2013-10-02 CN disclosed