SCHEMBL19561696

SCHEMBL19561696

CC/C=C(\C)Nc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 8/20 0.53
▸ KDM4E B2RXH2 3/20 0.53
▸ HPGD P15428 3/20 0.53
▸ GAA P10253 3/20 0.53
▸ TAS2R38 P59533 2/20 0.48
▸ HSD17B10 Q99714 2/20 0.48
▸ NAPRT Q6XQN6 1/20 0.48
▸ ALDH1A1 P00352 4/20 0.45
▸ L3MBTL1 Q9Y468 2/20 0.45
▸ MAPK1 P28482 1/20 0.45
▸ KMT2A Q03164 3/20 0.43
▸ TDP1 Q9NUW8 1/20 0.42
▸ NPC1 O15118 2/20 0.42
▸ RAB9A P51151 2/20 0.42
▸ TAAR1 Q96RJ0 1/20 0.42
▸ POLB P06746 1/20 0.42
▸ TP53 P04637 1/20 0.41
▸ EPHX1 P07099 1/20 0.41
▸ TSHR P16473 1/20 0.41
▸ EPHX2 P34913 1/20 0.41

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
SCHEMBL27175344 0.82 TDP1 (0.50) MAPTALDH1A1TDP1NPC1RAB9A
SCHEMBL22760406 0.82 MAPT (0.52) MAPTKDM4EHPGDGAATAS2R38
SCHEMBL29769229 0.80 ALDH1A1 (0.59) MAPTKDM4EGAAALDH1A1MAPK1
SCHEMBL18469398 0.80 HSD17B10 (0.56) MAPTHPGDHSD17B10ALDH1A1KMT2A
SCHEMBL11096463 0.79 SMN1; SMN2 (0.47) HPGDALDH1A1L3MBTL1KMT2ANPC1
SCHEMBL19954726 0.78 HDAC1 (0.39) MAPTKDM4EHPGDGAAALDH1A1
SCHEMBL9253909 0.78 MAPT (0.61) MAPTKDM4EHPGDGAATAS2R38
SCHEMBL12440049 0.78 MAPT (0.61) MAPTKDM4EHPGDGAATAS2R38
SCHEMBL12113186 0.78 MAPT (0.61) MAPTKDM4EHPGDGAATAS2R38
SCHEMBL14402891 0.78 MAPT (0.46) MAPTKDM4EHPGDGAATAS2R38

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
WO-2023144736-A1 COMPOSITIONS FOR PREVENTING OR TREATING PULMONARY ARTERIAL HYPERTENSION CHONG KUN DANG PHARMACEUTICAL CORP. (KR) 2023-08-03 — — WO disclosed
WO-2023144737-A1 COMPOSITIONS FOR PREVENTING OR TREATING HEART FAILURE (HF) CHONG KUN DANG PHARMACEUTICAL CORP. (KR) 2023-08-03 — — WO disclosed
EP-3812380-A1 HETEROCYCLIC COMPOUND, ORGANIC LIGHT EMITTING DIODE COMPRISING SAME, COMPOSITION FOR ORGANIC LAYER OF ORGANIC LIGHT EMITTING DIODE, AND METHOD FOR MANUFACTURING ORGANIC LIGHT EMITTING DIODE LT Materials Co., Ltd. (KR) 2021-04-28 — — EP disclosed
EP-3052506-B1 AZABORININE DERIVATIVES, THEIR SYNTHESIS AND USE IN ORGANIC ELECTRONIC DEVICES FLEXENABLE LTD (GB) 2020-06-03 — — EP disclosed
EP-3026056-B1 ORGANOMETALLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO LTD (KR) 2017-11-08 — — EP disclosed
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