SCHEMBL23637519

SCHEMBL23637519

Cc1cc(C)c(N2CCN(C34CC5CC(C3)C3C(C5)C34)C2)c(C)c1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33

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
SCHEMBL1046899 0.74 ALDH1A1 (0.38) ALDH1A1POLBMAPTHTTSMN1; SMN2
SCHEMBL20032907 0.74 ALDH1A1 (0.38) ALDH1A1POLBMAPTHTTSMN1; SMN2
Hydrochloric Acid SCHEMBL819402 0.73 ALDH1A1 (0.38) ALDH1A1POLBMAPTHTTSMN1; SMN2
SCHEMBL25246573 0.73 ALDH1A1 (0.38) ALDH1A1POLBMAPTHTTSMN1; SMN2
SCHEMBL283988 0.65 ALDH1A1 (0.52) ALDH1A1POLBMAPTHTTSMN1; SMN2
SCHEMBL28532318 0.64 ALDH1A1 (0.32) ALDH1A1POLB
Hydrochloric Acid SCHEMBL28554078 0.63 ALDH1A1 (0.50) ALDH1A1POLBMAPTHTTSMN1; SMN2
Hydrochloric Acid SCHEMBL451487 0.63 ALDH1A1 (0.50) ALDH1A1POLBMAPTHTTSMN1; SMN2
Bromide SCHEMBL1608735 0.63 ALDH1A1 (0.50) ALDH1A1POLBMAPTHTTSMN1; SMN2
SCHEMBL20106885 0.61 ALDH1A1 (0.60) ALDH1A1POLBMAPTHTTSMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3848378-A1 TETRADENTATE DIAMINODIPHOSPHINE LIGAND AND TRANSITION METAL COMPLEX, AND METHOD FOR MANUFACTURING SAME AND APPLICATION FOR SAME Takasago International Corporation (JP) 2021-07-14 — — EP disclosed
Send feedback