SCHEMBL28174148

SCHEMBL28174148

OCCCC1=CCN(Cc2ccccc2)C=C1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ CYP11B1 P15538 1/20 0.40
▸ CYP11B2 P19099 1/20 0.40
▸ POLB P06746 1/20 0.40
▸ SIGMAR1 Q99720 4/20 0.37
▸ CCR3 P51677 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.35
▸ LTA4H P09960 1/20 0.35
▸ EPHX2 P34913 1/20 0.35
▸ MEN1 O00255 2/20 0.34
▸ KMT2A Q03164 2/20 0.34
▸ GAA P10253 1/20 0.33
▸ OPRM1 P35372 1/20 0.33
▸ OPRD1 P41143 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ CXCR4 P61073 1/20 0.33
▸ GBA1 P04062 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
SCHEMBL11048801 0.78 SIGMAR1 (0.41) POLBSIGMAR1
SCHEMBL9755772 0.73 SLC6A3 (0.42) POLBSIGMAR1TDP1MEN1KMT2A
Formamide SCHEMBL28854308 0.72 SIGMAR1 (0.36) SIGMAR1GAA
SCHEMBL25379874 0.71 LMNA (0.41) POLBSIGMAR1GAAKDM4E
SCHEMBL8804597 0.71 SIGMAR1 (0.39) POLBSIGMAR1KDM4E
SCHEMBL10619250 0.71 SIGMAR1 (0.36) SIGMAR1MEN1KMT2AGAAKDM4E
SCHEMBL24609402 0.71 CYP11B1 (0.40) CYP11B1CYP11B2POLBSIGMAR1CCR3
Bromide SCHEMBL29099282 0.70 SIGMAR1 (0.38) POLBSIGMAR1TDP1KMT2A
SCHEMBL28790693 0.70 ALDH1A1 (0.41) SIGMAR1MEN1KMT2AGAA
Bromide SCHEMBL28711468 0.69 SIGMAR1 (0.37) CYP11B1CYP11B2SIGMAR1TDP1KMT2A

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
CN-107207508-A 9H-pyrrolo-bipyridine derivatives UCB生物制药私人有限公司 2017-09-26 — — CN disclosed
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