SCHEMBL16805036

SCHEMBL16805036

Cc1cc(-c2ccc3ccccc3c2)nc(-c2cccc3ccccc23)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PIM1 P11309 1/20 0.53
▸ CTRC Q99895 1/20 0.49
▸ FLT3 P36888 2/20 0.46
▸ CYP1A2 P05177 2/20 0.45
▸ RAC1 P63000 2/20 0.45
▸ ENPP3 O14638 1/20 0.44
▸ ENPP1 P22413 1/20 0.44
▸ CYP1A1 P04798 1/20 0.43
▸ CYP1B1 Q16678 1/20 0.43
▸ TUBB4A P04350 1/20 0.42
▸ TUBB P07437 1/20 0.42
▸ TUBA3C P0DPH7 1/20 0.42
▸ TUBA1B P68363 1/20 0.42
▸ TUBA4A P68366 1/20 0.42
▸ TUBB4B P68371 1/20 0.42
▸ TUBB3 Q13509 1/20 0.42
▸ TUBB2A Q13885 1/20 0.42
▸ TUBB8 Q3ZCM7 1/20 0.42
▸ TUBA3E Q6PEY2 1/20 0.42
▸ TUBA1A Q71U36 1/20 0.42

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
SCHEMBL16805055 0.88 PIM1 (0.53) PIM1CTRCFLT3CYP1A2RAC1
SCHEMBL16805033 0.87 MEN1 (0.50) FLT3CYP1A2ENPP3ENPP1TUBB4A
SCHEMBL25774987 0.86 FLT3 (0.49) FLT3CYP1A2ENPP3ENPP1MEN1
SCHEMBL11978725 0.85 CTRC (0.61) CTRCCYP1A2RAC1CYP1A1CYP1B1
SCHEMBL17970028 0.84 PIM1 (0.56) PIM1CTRCCYP1A2RAC1ENPP3
SCHEMBL28136194 0.84 PIM1 (0.55) PIM1CYP1A2ENPP3ENPP1CYP1A1
SCHEMBL13203132 0.84 CYP1A1 (0.53) PIM1CTRCCYP1A2ENPP3ENPP1
SCHEMBL10051200 0.83 PIM1 (0.54) PIM1CTRCCYP1A2RAC1CYP1A1
SCHEMBL18538864 0.82 CTRC (0.55) CTRCCYP1A2RAC1CYP1A1CYP1B1
SCHEMBL17547281 0.82 CYP1A2 (0.71) PIM1CYP1A2CYP1A1CYP1B1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9666807-B2 Organic light emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2017-05-30 — — US disclosed
US-20160111664-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-04-21 — — US disclosed
US-20160111664-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-04-21 — — US disclosed
US-20160028017-A1 ORGANIC LIGHT EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-01-28 — — US disclosed
US-20150171337-A1 AMINE-BASED COMPOUNDS AND ORGANIC LIGHT-EMITTING DEVICES COMPRISING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2015-06-18 — — US disclosed
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