SCHEMBL444017

SCHEMBL444017

c1ccc2c(c1)ccc1c(-c3ccc4ccc5cccc6ccc3c4c56)cccc12

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.60
HSD17B10 Q99714 7/20 0.60
HPGD P15428 5/20 0.60
CYP1A2 P05177 4/20 0.60
THRB P10828 1/20 0.60
ERBB2 P04626 1/20 0.59
FYN P06241 1/20 0.59
MAOA P21397 1/20 0.59
ACHE P22303 1/20 0.59
AHR P35869 1/20 0.59
HPRT1 P00492 3/20 0.58
TSHR P16473 5/20 0.50
TDP1 Q9NUW8 3/20 0.50
CYP2A6 P11509 1/20 0.50
L3MBTL1 Q9Y468 3/20 0.47
CYP3A4 P08684 2/20 0.47
CYP1B1 Q16678 2/20 0.46
CYP1A1 P04798 1/20 0.46
MAPK1 P28482 3/20 0.46
HIF1A Q16665 3/20 0.46

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
SCHEMBL441488 0.94 HSD17B10 (0.56) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL3792057 0.91 HSD17B10 (0.58) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL30744773 0.91 HSD17B10 (0.58) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL3786972 0.91 HSD17B10 (0.58) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL2956150 0.91 ALDH1A1 (0.64) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL27694292 0.90 ALDH1A1 (0.64) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL5334139 0.89 ALDH1A1 (0.56) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL27892183 0.88 CYP1A2 (0.66) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL29814212 0.87 ALDH1A1 (0.61) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL29413360 0.87 ALDH1A1 (0.61) ALDH1A1HSD17B10HPGDCYP1A2THRB

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
US-8846846-B2 Naphthalene derivative, resist bottom layer material, and patterning process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2014-09-30 US claimed
US-20120064725-A1 NAPHTHALENE DERIVATIVE, RESIST BOTTOM LAYER MATERIAL, AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2012-03-15 US claimed
CN-102464568-B 9, 10-bisphenylphenanthrene derivative and organic light-emitting diode thereof ZHENG JIANHONG (CN) 2015-11-25 CN disclosed
US-9045587-B2 Naphthalene derivative, resist bottom layer material, and patterning process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2015-06-02 US disclosed
US-20140363768-A1 NAPHTHALENE DERIVATIVE, RESIST BOTTOM LAYER MATERIAL, AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2014-12-11 US disclosed
US-8846846-B2 Naphthalene derivative, resist bottom layer material, and patterning process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2014-09-30 US disclosed
CN-102464568-A 9, 10-bisphenylphenanthrene derivative and organic light-emitting diode thereof CHIEN-HONG CHENG 2012-05-23 CN disclosed
US-20120064725-A1 NAPHTHALENE DERIVATIVE, RESIST BOTTOM LAYER MATERIAL, AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2012-03-15 US disclosed