SCHEMBL100555

SCHEMBL100555

O=C(OCc1ccccc1)N1CCC(CO)C1

nearest known ligand 0.64

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.64
RAB9A P51151 3/20 0.64
NPC1 O15118 2/20 0.64
CYP2C19 P33261 1/20 0.61
GRIN2B Q13224 9/20 0.58
CYP2D6 P10635 4/20 0.57
CYP2C9 P11712 4/20 0.57
MEN1 O00255 1/20 0.55
KMT2A Q03164 1/20 0.55
NPSR1 Q6W5P4 1/20 0.55
CYP3A4 P08684 3/20 0.54
HTT P42858 1/20 0.52
TACR3 P29371 1/20 0.50
FAAH O00519 1/20 0.50
PDE4B Q07343 1/20 0.49

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
SCHEMBL3444915 1.00 SMN1; SMN2 (0.64) SMN1; SMN2RAB9ANPC1CYP2C19GRIN2B
SCHEMBL541346 1.00 SMN1; SMN2 (0.64) SMN1; SMN2RAB9ANPC1CYP2C19GRIN2B
SCHEMBL3277927 0.92 SMN1; SMN2 (0.58) SMN1; SMN2RAB9ANPC1CYP2C19GRIN2B
SCHEMBL3272711 0.92 SMN1; SMN2 (0.58) SMN1; SMN2RAB9ANPC1CYP2C19GRIN2B
SCHEMBL1320424 0.92 SMN1; SMN2 (0.58) SMN1; SMN2RAB9ANPC1CYP2C19GRIN2B
SCHEMBL458805 0.92 SMN1; SMN2 (0.72) SMN1; SMN2RAB9ANPC1CYP2C19GRIN2B
SCHEMBL5870802 0.91 SMN1; SMN2 (0.56) SMN1; SMN2RAB9ANPC1CYP2C19GRIN2B
SCHEMBL5768608 0.89 SMN1; SMN2 (0.61) SMN1; SMN2RAB9ANPC1CYP2C19GRIN2B
SCHEMBL19221832 0.89 SMN1; SMN2 (0.61) SMN1; SMN2RAB9ANPC1CYP2C19GRIN2B
SCHEMBL3154275 0.88 SMN1; SMN2 (0.58) SMN1; SMN2RAB9ANPC1CYP2C19GRIN2B

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 144 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12545689-B2 Macrocyclic LRRK2 kinase inhibitors ONCODESIGN PRECISION MEDICINE (FR) 2026-02-10 US disclosed
EP-4146658-B1 NEW MACROCYCLIC LRRK2 KINASE INHIBITORS ONCODESIGN PREC MEDICINE OPM (FR) 2025-10-29 EP disclosed
EP-4587446-A1 BIFUNCTIONAL COMPOUNDS AND PHARMACEUTICAL USES THEREOF Risen (Suzhou) Pharma Tech Co., Ltd. (CN) 2025-07-23 EP disclosed
CN-119409710-A Oxamide substituted hepatitis b virus tricyclic inhibitors 圣拉斐尔医院有限公司 2025-02-11 CN disclosed
CN-114555608-B Oxamide substituted hepatitis b virus tricyclic inhibitors 圣拉斐尔医院有限公司 2024-11-01 CN disclosed
WO-2024055112-A1 BIFUNCTIONAL COMPOUNDS AND PHARMACEUTICAL USES THEREOF Risen (Suzhou) Pharma Tech Co., Ltd. (CN) 2024-03-21 WO disclosed
US-20240059712-A1 BIFUNCTIONAL COMPOUNDS AND PHARMACEUTICAL USES THEREOF Risen (Suzhou) Pharma Tech Co., Ltd. (CN) 2024-02-22 US disclosed
EP-3838903-B1 PYRROLO[2,3-D]PYRIMIDINE DERIVATIVE AS JANUS KINASE INHIBITOR INCYTE HOLDINGS CORP (US) 2023-11-22 EP disclosed
US-20230357269-A1 NEW MACROCYCLIC LRRK2 KINASE INHIBITORS ONCODESIGN PRECISION MEDICINE (FR) 2023-11-09 US disclosed
US-20230357269-A1 NEW MACROCYCLIC LRRK2 KINASE INHIBITORS ONCODESIGN PRECISION MEDICINE (FR) 2023-11-09 US disclosed
US-20050107423-A1 Quinolone antibacterial agents ELLSWORTH EDMUND L (US) 2005-05-19 US disclosed
US-20050080078-A1 Method of treating addiction or dependence using a ligand for a monoamine receptor or transporter SEPRACOR, INC. (US) 2005-04-14 US disclosed
WO-2005026154-A1 QUINOLONE ANTIBACTERIAL AGENTS WARNER-LAMBERT COMPANY LLC (US) 2005-03-24 WO disclosed
WO-2005026165-A1 QUINOLONE ANTIBACTERIAL AGENTS WARNER-LAMBERT COMPANY LLC (US) 2005-03-24 WO disclosed
US-20040077706-A1 Ligands for monoamine receptors and transporters, and methods of use thereof AQUILA BRIAN M (US) 2004-04-22 US disclosed
US-20030050309-A1 Ligands for monoamine receptors and transporters, and methods of use thereof SEPRACOR INC. 2003-03-13 US disclosed
EP-1206260-A4 SRC KINASE INHIBITOR COMPOUNDS MERCK & CO INC (US) 2002-10-30 EP disclosed
EP-1206260-A1 SRC KINASE INHIBITOR COMPOUNDS Merck & Co., Inc. (US) 2002-05-22 EP disclosed
US-6329380-B1 PYRIMIDINE BENZIMIDIZAZOLE, PYRIMIDINEIMIDAZOLE OR PYRIDINE IMIDAZOLE COMPOUNDS FOR ANTICANCER AGENTS OR ATHEROSCLEROSIS MERCK & CO., INC. 2001-12-11 US disclosed
WO-2001000207-A1 SRC KINASE INHIBITOR COMPOUNDS MERCK & CO., INC. (US) 2001-01-04 WO 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 (7 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-20050080078-A1 Method of treating addiction or dependence using a ligand for a monoamine receptor or transporter PNMT, TAAR1, OPRL1 SMN1; SMN2 3005/4885RAB9A 3636/4885NPC1 1102/4885
US-12545689-B2 Macrocyclic LRRK2 kinase inhibitors LRRK2, SNCA, ROS1 SMN1; SMN2 516/4885RAB9A 191/4885NPC1 1905/4885
US-20030050309-A1 Ligands for monoamine receptors and transporters, and methods of use thereof SLC6A2, OPRL1, SLC18A2 SMN1; SMN2 872/4885RAB9A 1348/4885NPC1 145/4885
US-20240059712-A1 BIFUNCTIONAL COMPOUNDS AND PHARMACEUTICAL USES THEREOF KRAS, MDM2, NRAS SMN1; SMN2 2524/4885RAB9A 112/4885NPC1 3457/4885
US-20040077706-A1 Ligands for monoamine receptors and transporters, and methods of use thereof SLC6A2, OPRL1, SLC18A2 SMN1; SMN2 872/4885RAB9A 1348/4885NPC1 145/4885
US-20050107423-A1 Quinolone antibacterial agents NQO2, MRPL21, TOP1 SMN1; SMN2 3447/4885RAB9A 838/4885NPC1 1057/4885
US-20230357269-A1 NEW MACROCYCLIC LRRK2 KINASE INHIBITORS LRRK2, RIN1, GRK3 SMN1; SMN2 887/4885RAB9A 209/4885NPC1 1641/4885

“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.