SCHEMBL31397622

SCHEMBL31397622

Clc1cc(Br)ccc1-c1ccc(CNCC2CCNCC2)o1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ SLC2A1 P11166 1/20 0.98
▸ PRMT5 O14744 1/20 0.48
▸ WDR77 Q9BQA1 1/20 0.48
▸ EP300 Q09472 6/20 0.42
▸ PIM1 P11309 2/20 0.41
▸ CREBBP Q92793 1/20 0.37
▸ SLC6A4 P31645 1/20 0.37
▸ CSNK2A2 P19784 1/20 0.36
▸ CSNK2B P67870 1/20 0.36
▸ PIM3 Q86V86 1/20 0.36
▸ PIM2 Q9P1W9 1/20 0.36
▸ CHRM1 P11229 1/20 0.36
▸ FTO Q9C0B1 1/20 0.36
▸ POLB P06746 1/20 0.35

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
Hydrochloric Acid SCHEMBL31397599 0.99 SLC2A1 (1.00) SLC2A1PRMT5WDR77EP300PIM1
SCHEMBL24221655 0.88 SLC2A1 (0.78) SLC2A1PRMT5WDR77EP300CHRM1
SCHEMBL24221656 0.81 SLC2A1 (0.67) SLC2A1PRMT5WDR77EP300CHRM1
SCHEMBL27327471 0.67 SLC2A1 (0.49) SLC2A1FTOPOLB
SCHEMBL10119820 0.67 SLC6A4 (0.72) SLC2A1SLC6A4
SCHEMBL2265474 0.64 EP300 (0.48) SLC2A1PRMT5WDR77EP300POLB
SCHEMBL31507093 0.63 PRMT5 (0.70) SLC2A1PRMT5WDR77POLB
SCHEMBL21823849 0.62 ALDH1A1 (0.61) SLC2A1POLB
SCHEMBL6875538 0.61 SLC2A1 (0.43) SLC2A1POLB
SCHEMBL23330146 0.60 SLC2A1 (0.42) SLC2A1PRMT5WDR77PIM1SLC6A4

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
WO-2024263680-A1 METHODS FOR INHIBITION OF VIRAL INFECTION THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2024-12-26 — — WO disclosed
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