SCHEMBL31029938

SCHEMBL31029938

COc1ccccc1CPC1CCCCC1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.48
▸ MEN1 O00255 2/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ HRH3 Q9Y5N1 3/20 0.44
▸ HPGD P15428 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ IDO1 P14902 2/20 0.43
▸ TAAR1 Q96RJ0 1/20 0.43
▸ SIGMAR1 Q99720 1/20 0.42
▸ POLB P06746 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ CHRM2 P08172 1/20 0.42
▸ CHRM1 P11229 1/20 0.42
▸ KCNH2 Q12809 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
SCHEMBL11020973 1.00 LMNA (0.48) LMNAMEN1KMT2AHRH3HPGD
SCHEMBL8655896 0.86 HRH3 (0.48) LMNAMEN1KMT2AHRH3TAAR1
SCHEMBL30486831 0.84 KMT2A (0.33) LMNAMEN1KMT2AHRH3ALDH1A1
SCHEMBL11503834 0.78 LMNA (0.46) LMNAMEN1KMT2AHRH3HPGD
SCHEMBL11293433 0.76 LMNA (0.45) LMNAMEN1KMT2AHRH3HPGD
SCHEMBL6248108 0.75 LMNA (0.38) LMNAKMT2AALDH1A1
SCHEMBL7446651 0.74 CYP2D6 (0.50) LMNAMEN1KMT2AHRH3HPGD
SCHEMBL9472909 0.73 EPHX1 (0.45) SIGMAR1
SCHEMBL28169030 0.73 DPP4 (0.43) LMNAMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL28550991 0.72 SMN1; SMN2 (0.47) LMNAMEN1KMT2AHPGDSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118440267-A Chiral covalent organic framework compound and preparation method thereof, rhodium-loaded metal compound and application thereof, and preparation method of intermediate 河北科技大学 2024-08-06 — — CN claimed
CN-118440267-A Chiral covalent organic framework compound and preparation method thereof, rhodium-loaded metal compound and application thereof, and preparation method of intermediate 河北科技大学 2024-08-06 — — CN disclosed
CN-118440267-A Chiral covalent organic framework compound and preparation method thereof, rhodium-loaded metal compound and application thereof, and preparation method of intermediate 河北科技大学 2024-08-06 — — CN disclosed
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