SCHEMBL6522858

SCHEMBL6522858

C=C(CO)c1ccncc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAPRT Q6XQN6 1/20 0.42
CYP1A2 P05177 2/20 0.41
CYP3A4 P08684 2/20 0.41
CYP2D6 P10635 2/20 0.41
CYP2C19 P33261 2/20 0.41
KDM4E B2RXH2 2/20 0.41
MPO P05164 1/20 0.41
ADORA3 P0DMS8 1/20 0.41
CYP2A6 P11509 1/20 0.41
ALDH1A1 P00352 2/20 0.39
PLOD2 O00469 2/20 0.39
PLOD3 O60568 2/20 0.39
PLOD1 Q02809 2/20 0.39
CYP2C9 P11712 1/20 0.39
HPGD P15428 1/20 0.39
HIF1A Q16665 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
LMNA P02545 2/20 0.35

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
SCHEMBL14163731 0.82 KDM1A (0.51) CYP1A2CYP3A4CYP2D6CYP2C19KDM4E
SCHEMBL7558408 0.78 NAPRT (0.41) NAPRTCYP1A2CYP3A4CYP2D6CYP2C19
SCHEMBL2172789 0.78 NAPRT (0.41) NAPRTCYP1A2CYP3A4CYP2D6CYP2C19
SCHEMBL9155329 0.78 NAPRT (0.37) NAPRTCYP1A2CYP3A4CYP2D6CYP2C19
Bromide SCHEMBL5436825 0.76 NAPRT (0.39) NAPRTCYP1A2CYP3A4CYP2D6CYP2C19
SCHEMBL9365632 0.75 NAPRT (0.38) NAPRTCYP1A2CYP3A4CYP2D6CYP2C19
SCHEMBL93850 0.74 MAOA (0.54) NAPRTCYP3A4KDM4EHPGDSMN1; SMN2
SCHEMBL23176316 0.73 MAOA (0.40) NAPRTCYP1A2CYP3A4CYP2D6CYP2C19
SCHEMBL11203095 0.73 NAPRT (0.41) NAPRTCYP1A2CYP3A4CYP2D6CYP2C19
SCHEMBL26662143 0.73 ALDH1A1 (0.50) ALDH1A1PLOD2PLOD3PLOD1HIF1A

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 52 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114361456-B Water-based functional ion-conducting binder for lithium battery, preparation method and application 中国科学院化学研究所 2023-05-05 CN claimed
CN-114361456-A Water-based functional ion-conducting binder for lithium battery, preparation method and application 中国科学院化学研究所 2022-04-15 CN claimed
US-4303531-A VINYLPYRIDINE ION EXCHANGE RESIN KOEI CHEMICAL CO., LTD. (JP) 1981-12-01 US claimed
JP-58032609-A None JP disclosed
JP-58032609-A None JP disclosed
JP-58052312-A None JP disclosed
JP-58052312-A None JP disclosed
US-12290611-B2 Cell or tissue embedding device JAPAN VAM & POVAL CO., LTD. (JP) 2025-05-06 US disclosed
US-20250118863-A1 COMPOSITION CONTAINING INORGANIC-ORGANIC HYBRID COMPOUND SHIN-ETSU CHEMICAL CO., LTD. (JP) 2025-04-10 US disclosed
EP-4458900-A1 COMPOSITION CONTAINING INORGANIC/ORGANIC HYBRID COMPOUND SHIN-ETSU CHEMICAL CO., LTD. (JP) 2024-11-06 EP disclosed
EP-3586824-B1 CELL- OR TISSUE-EMBEDDING DEVICE JAPAN VAM & POVAL CO LTD (JP) 2024-09-04 EP disclosed
US-4960897-A Herbicide containing 1-(halogenomethyl)-vinyl pyridines MITSUBISHI KASEI CORPORATION (JP) 1990-10-02 US disclosed
EP-0281110-A2 N-[2-(pyridyl)propyl]-N-substituted sulfonamide, herbicide containing the same as an active ingredient and intermediate thereof MITSUBISHI KASEI CORPORATION (JP) 1988-09-07 EP disclosed
EP-0065352-B1 LIGHT-SENSITIVE POLYMER COMPOSITION Hitachi, Ltd. (JP) 1986-01-29 EP disclosed
JP-S5852312-A PRODUCTION OF 2-(4-PYRIDYL)ALLYL ALCOHOL POLYMER NITTO BOSEKI CO LTD 1983-03-28 JP disclosed
JP-S5852312-A PRODUCTION OF 2-(4-PYRIDYL)ALLYL ALCOHOL POLYMER NITTO BOSEKI CO LTD 1983-03-28 JP disclosed
JP-S5832609-A PREPARATION OF HIGHLY POLYMERIZED POLYMER OF 2-(4-PYRIDYL) ALLYL ALCOHOL NITTO BOSEKI CO LTD 1983-02-25 JP disclosed
JP-S5832609-A PREPARATION OF HIGHLY POLYMERIZED POLYMER OF 2-(4-PYRIDYL) ALLYL ALCOHOL NITTO BOSEKI CO LTD 1983-02-25 JP disclosed
EP-0065352-A2 Light-sensitive polymer composition Hitachi, Ltd. (JP) 1982-11-24 EP disclosed
US-4303531-A VINYLPYRIDINE ION EXCHANGE RESIN KOEI CHEMICAL CO., LTD. (JP) 1981-12-01 US disclosed