SCHEMBL11033516

SCHEMBL11033516

C=Cc1ccccc1CNC(C)(C)O

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.34
▸ CYP2D6 P10635 2/20 0.33
▸ TSHR P16473 1/20 0.33
▸ HIF1A Q16665 1/20 0.33
▸ MAPT P10636 1/20 0.32
▸ CYP3A4 P08684 2/20 0.31
▸ CYP2C9 P11712 2/20 0.31
▸ CYP2C19 P33261 2/20 0.31
▸ KMT2A Q03164 2/20 0.31
▸ ATM Q13315 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.30
▸ HTT P42858 2/20 0.30
▸ MEN1 O00255 1/20 0.30

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
SCHEMBL11032962 0.86 MEN1 (0.40) ALDH1A1CYP2D6HIF1AMAPTKMT2A
SCHEMBL17329411 0.81 ALDH1A1 (0.33) ALDH1A1CYP3A4CYP2C9CYP2C19ATM
SCHEMBL1930692 0.76 SLC6A4 (0.41) ALDH1A1CYP2D6TSHRHIF1AMAPT
Hydrochloric Acid SCHEMBL10445033 0.74 KDM4E (0.43) ALDH1A1MAPTCYP3A4KMT2AKDM4E
SCHEMBL10989194 0.74 LMNA (0.38) ALDH1A1CYP2D6TSHRHIF1ACYP3A4
Hydrochloric Acid SCHEMBL7208296 0.73 THRA (0.33) —
SCHEMBL7741253 0.73 ALDH1A1 (0.38) ALDH1A1CYP2D6TSHRHIF1AKMT2A
SCHEMBL10979416 0.73 TSHR (0.45) ALDH1A1CYP2D6TSHRHIF1ACYP3A4
SCHEMBL8749936 0.73 TSHR (0.45) ALDH1A1CYP2D6TSHRHIF1AKDM4E
SCHEMBL5152330 0.72 MTNR1A (0.48) ALDH1A1CYP2C9KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0052330-B1 NOVEL RESIN COMPOSITION, COATING MATERIAL COMPRISING SAID RESIN COMPOSITION AND METHOD FOR FORMING COATINGS Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1984-09-05 — — EP claimed
US-4447580-A POLYMER CONSISTING OF UNSATD AROMATIC AMINE AND UNSATURATED COMPOUND WITH ELECTRON ATTRACTIVE GROUP ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1984-05-08 — — US claimed
EP-0052330-A1 Novel resin composition, coating material comprising said resin composition and method for forming coatings Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1982-05-26 — — EP claimed
EP-0052330-B1 NOVEL RESIN COMPOSITION, COATING MATERIAL COMPRISING SAID RESIN COMPOSITION AND METHOD FOR FORMING COATINGS Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1984-09-05 — — EP disclosed
US-4447580-A POLYMER CONSISTING OF UNSATD AROMATIC AMINE AND UNSATURATED COMPOUND WITH ELECTRON ATTRACTIVE GROUP ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1984-05-08 — — US disclosed
EP-0052330-A1 Novel resin composition, coating material comprising said resin composition and method for forming coatings Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1982-05-26 — — EP disclosed
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