SCHEMBL15768885

SCHEMBL15768885

O=C(NC1CC1)c1ccc(-c2ccc(O)cc2)cc1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.74
NPC1 O15118 4/20 0.74
SMN1; SMN2 Q16637 2/20 0.74
MEN1 O00255 1/20 0.74
KMT2A Q03164 1/20 0.74
SMYD3 Q9H7B4 2/20 0.64
FYN P06241 1/20 0.55
MAPT P10636 1/20 0.54
USP7 Q93009 1/20 0.53
CYP1A2 P05177 1/20 0.53
HPGD P15428 1/20 0.53
CYP2C19 P33261 1/20 0.53
MAPK14 Q16539 2/20 0.51
CYP46A1 Q9Y6A2 1/20 0.51
ESR1 P03372 1/20 0.50
ESRRG P62508 1/20 0.50
ESR2 Q92731 1/20 0.50
MAPK11 Q15759 1/20 0.50
PTPN1 P18031 1/20 0.50
PTPN11 Q06124 1/20 0.50

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
SCHEMBL1477302 0.94 RAB9A (0.65) RAB9ANPC1SMN1; SMN2MEN1KMT2A
SCHEMBL2920549 0.87 NPC1 (0.69) RAB9ANPC1SMN1; SMN2MEN1KMT2A
SCHEMBL2979351 0.85 RAB9A (1.00) RAB9ANPC1SMN1; SMN2MEN1KMT2A
SCHEMBL2916169 0.85 NPC1 (0.72) RAB9ANPC1SMN1; SMN2KMT2ACYP1A2
SCHEMBL517452 0.85 NPC1 (0.73) RAB9ANPC1SMN1; SMN2MEN1KMT2A
SCHEMBL3633642 0.84 RAB9A (0.72) RAB9ANPC1SMN1; SMN2MEN1KMT2A
SCHEMBL517808 0.84 NPC1 (0.72) RAB9ANPC1SMN1; SMN2MEN1KMT2A
SCHEMBL518043 0.83 NPC1 (0.74) RAB9ANPC1SMN1; SMN2MEN1KMT2A
SCHEMBL517178 0.83 NPC1 (0.74) RAB9ANPC1SMN1; SMN2MEN1KMT2A
SCHEMBL29927547 0.83 NPC1 (0.74) RAB9ANPC1SMN1; SMN2MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2739608-B1 INSULIN SECRETION PROMOTING AGENTS VAL-CHUM LTD PARTNERSHIP (CA) 2017-09-06 EP disclosed
US-9518016-B2 Insulin secretion promoting agents VAL-CHUM, LIMITED PARTNERSHIP (CA) 2016-12-13 US disclosed
US-9518016-B2 Insulin secretion promoting agents VAL-CHUM, LIMITED PARTNERSHIP (CA) 2016-12-13 US disclosed
US-9518016-B2 Insulin secretion promoting agents VAL-CHUM, LIMITED PARTNERSHIP (CA) 2016-12-13 US disclosed
US-20160264527-A1 INSULIN SECRETION PROMOTING AGENTS CENTRE HOSPITALIER DE L'UNIVERSITE DE MONTREAL (CA) 2016-09-15 US disclosed
US-20160264527-A1 INSULIN SECRETION PROMOTING AGENTS CENTRE HOSPITALIER DE L'UNIVERSITE DE MONTREAL (CA) 2016-09-15 US disclosed
US-20160264527-A1 INSULIN SECRETION PROMOTING AGENTS CENTRE HOSPITALIER DE L'UNIVERSITE DE MONTREAL (CA) 2016-09-15 US disclosed
US-9371285-B2 Insulin secretion promoting agents VAL-CHUM, LIMITED PARTNERSHIP (CA) 2016-06-21 US disclosed
US-9371285-B2 Insulin secretion promoting agents VAL-CHUM, LIMITED PARTNERSHIP (CA) 2016-06-21 US disclosed
US-9371285-B2 Insulin secretion promoting agents VAL-CHUM, LIMITED PARTNERSHIP (CA) 2016-06-21 US disclosed
WO-2015127559-A1 ABHD6 ANTAGONISTS FOR PROMOTING BROWNING OF WHITE ADIPOSE TISSUE AND BROWN ADIPOSE TISSUE FUNCTIONALITY VAL-CHUM, LIMITED PARTNERSHIP (CA) 2015-09-03 WO disclosed
US-20140163077-A1 INSULIN SECRETION PROMOTING AGENTS VAL-CHUM, LIMITED PARTNERSHIP (CA) 2014-06-12 US disclosed
US-20140163077-A1 INSULIN SECRETION PROMOTING AGENTS VAL-CHUM, LIMITED PARTNERSHIP (CA) 2014-06-12 US disclosed
US-20140163077-A1 INSULIN SECRETION PROMOTING AGENTS VAL-CHUM, LIMITED PARTNERSHIP (CA) 2014-06-12 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20160264527-A1 INSULIN SECRETION PROMOTING AGENTS IAPP, GPR119, PNLIP RAB9A 2214/4885NPC1 600/4885SMN1; SMN2 2343/4885
US-20140163077-A1 INSULIN SECRETION PROMOTING AGENTS IAPP, GPR119, PNLIP RAB9A 2214/4885NPC1 600/4885SMN1; SMN2 2343/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.