SCHEMBL23551102

SCHEMBL23551102

CC(C)C1CCN(CCCN(C)C)CC1

nearest known ligand 0.61

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ALOX15 P16050 1/20 0.46
▸ GNAI3 P08754 5/20 0.37
▸ GNAO1 P09471 5/20 0.37
▸ GNAI1 P63096 5/20 0.37
▸ TLR9 Q9NR96 2/20 0.37
▸ TLR8 Q9NR97 2/20 0.37
▸ TLR7 Q9NYK1 2/20 0.37
▸ HTR4 Q13639 2/20 0.37
▸ PIM1 P11309 1/20 0.34
▸ OPRL1 P41146 1/20 0.34

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
SCHEMBL26850073 0.93 GNAO1 (0.42) ALOX15GNAI3GNAO1GNAI1OPRL1
SCHEMBL24684743 0.93 GNAO1 (0.42) ALOX15GNAI3GNAO1GNAI1OPRL1
SCHEMBL16980461 0.89 ALOX15 (0.35) ALOX15GNAI3GNAO1GNAI1PIM1
SCHEMBL23696232 0.84 GNAI3 (0.40) ALOX15GNAI3GNAO1GNAI1
SCHEMBL26494066 0.84 GNAO1 (0.44) GNAI3GNAO1GNAI1
SCHEMBL21106055 0.83 GNAI3 (0.36) ALOX15GNAI3GNAO1GNAI1
SCHEMBL24023549 0.81 ALOX15 (0.38) ALOX15HTR4PIM1
SCHEMBL23696428 0.80 GNAI3 (0.34) ALOX15GNAI3GNAO1GNAI1
SCHEMBL1615678 0.80 GNAO1 (0.50) GNAI3GNAO1GNAI1OPRL1
SCHEMBL26843896 0.80 GNAO1 (0.40) GNAI3GNAO1GNAI1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022133480-A1 ARYL HYDROCARBON RECEPTOR (AHR) AGONISTS AND USES THEREOF Ikena Oncology, Inc. (US) 2022-06-23 — — WO disclosed
WO-2021127302-A1 2-(1H-INDOLE-3-CARBONYL)-THIAZOLE-4-CARBOXAMIDE DERIVATIVES AND RELATED COMPOUNDS AS ARYL HYDROCARBON RECEPTOR (AHR) AGONISTS FOR THE TREATMENT OF E.G. ANGIOGENESIS IMPLICATED OR INFLAMMATORY DISORDERS Ikena Oncology, Inc. (US) 2021-06-24 — — WO disclosed
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