SCHEMBL9871925

SCHEMBL9871925

O=C(Cl)Oc1cccc2[nH]ccc12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RHEB Q15382 4/20 0.51
TRPA1 O75762 1/20 0.45
HTR1A P08908 3/20 0.43
KMT2A Q03164 3/20 0.43
PARP1 P09874 1/20 0.43
HSD17B10 Q99714 1/20 0.43
MCL1 Q07820 1/20 0.43
AHR P35869 1/20 0.43
TUBB4A P04350 1/20 0.43
TUBB P07437 1/20 0.43
TUBA3C P0DPH7 1/20 0.43
TUBA1B P68363 1/20 0.43
TUBA4A P68366 1/20 0.43
TUBB4B P68371 1/20 0.43
TUBB3 Q13509 1/20 0.43
TUBB2A Q13885 1/20 0.43
TUBB8 Q3ZCM7 1/20 0.43
TUBA3E Q6PEY2 1/20 0.43
TUBA1A Q71U36 1/20 0.43
TUBA1C Q9BQE3 1/20 0.43

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
SCHEMBL2312464 0.84 RHEB (0.49) RHEBTRPA1HTR1AKMT2APARP1
SCHEMBL594038 0.83 SLC22A6 (0.63) RHEBTRPA1HTR1AKMT2APARP1
SCHEMBL29511854 0.83 SLC22A6 (0.63) RHEBTRPA1HTR1AKMT2APARP1
SCHEMBL8801424 0.80 HTR1B (0.50) RHEBTRPA1HTR1AKMT2AHSD17B10
SCHEMBL8995160 0.79 KMT2A (0.69) RHEBTRPA1KMT2APARP1HSD17B10
SCHEMBL30248943 0.79 ELANE (0.49) RHEBTRPA1HTR1AKMT2APARP1
SCHEMBL8583050 0.79 SLC22A6 (0.46) RHEBTRPA1HTR1AKMT2APARP1
SCHEMBL30514396 0.79 KMT2A (0.69) RHEBTRPA1KMT2APARP1HSD17B10
SCHEMBL29938170 0.79 BCHE (0.60) RHEBHTR1AKMT2AHTR1BDRD3
SCHEMBL7495860 0.79 BCHE (0.60) RHEBHTR1AKMT2AHTR1BDRD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4387608-A1 PRODRUGS AND DERIVATIVES OF PSILOCIN AND USES THEREOF Terran Biosciences, Inc. (US) 2024-06-26 EP disclosed
WO-2023023347-A1 PRODRUGS AND DERIVATIVES OF PSILOCIN AND USES THEREOF TERRAN BIOSCIENCES INC. (US) 2023-02-23 WO disclosed
US-5017582-A Analgesics SANDOZ LTD. (CH) 1991-05-21 US disclosed
US-4910207-A Antipsychotic agent NOVARTIS AG (CH) 1990-03-20 US disclosed
US-4803199-A SEROTONIN ANTAGONIST, ANALGESIC ANTIARRHYTHMIC AGENTS NOVARTIS AG (CH) 1989-02-07 US disclosed