SCHEMBL11322826

SCHEMBL11322826

N=C=NC(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KCNN4 O15554 5/20 0.37
▸ MAPK1 P28482 1/20 0.37
▸ ALDH1A1 P00352 3/20 0.36
▸ TSHR P16473 2/20 0.36
▸ TAAR1 Q96RJ0 1/20 0.34
▸ ALOX15 P16050 1/20 0.34
▸ ESR1 P03372 2/20 0.33
▸ ESR2 Q92731 2/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ MAPT P10636 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ KIF11 P52732 1/20 0.31
▸ CYP2C19 P33261 1/20 0.31
▸ HIF1A Q16665 1/20 0.31

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
SCHEMBL28153949 0.79 TSHR (0.32) KCNN4ALDH1A1TSHR
SCHEMBL27641531 0.76 CYP2D6 (0.36) KCNN4MAPK1ALDH1A1TSHRCYP3A4
(Isothiocyanatomethanetriyl)Tribenzene SCHEMBL957836 0.75 MIF (0.42) KCNN4MAPK1ALDH1A1TSHRCYP3A4
SCHEMBL3517726 0.75 KCNN4 (0.36) KCNN4MAPK1ALDH1A1TSHRTAAR1
SCHEMBL9439627 0.70 KCNN4 (0.42) KCNN4MAPK1ALDH1A1TSHRTAAR1
SCHEMBL1203968 0.70 KCNN4 (0.41) KCNN4MAPK1ALDH1A1TSHRTAAR1
SCHEMBL19056981 0.70 TSHR (0.37) KCNN4ALDH1A1TSHR
SCHEMBL19056980 0.70 TSHR (0.37) KCNN4ALDH1A1TSHR
SCHEMBL26134054 0.70 MIF (0.43) KCNN4ALDH1A1TSHRTAAR1
SCHEMBL3282883 0.69 KCNN4 (0.45) KCNN4MAPK1ALDH1A1TSHRTAAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113518811-B Easy-to-adhere polyester film 东洋纺株式会社 2024-01-02 — — CN disclosed
CN-113518811-A Easily adhesive polyester film 东洋纺株式会社 2021-10-19 — — CN disclosed
CN-107922718-A Polybutylene terephthalate (PBT) resin combination 胜技高分子株式会社 2018-04-17 — — CN disclosed
US-4293642-A CROSSLINKING WITH CARBODIIMIDE GAF CORPORATION (US) 1981-10-06 — — US disclosed
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