SCHEMBL5582569

SCHEMBL5582569

COc1ccc(C(=O)Oc2ccc(CO)cc2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.60
LMNA P02545 2/20 0.60
CYP1A2 P05177 1/20 0.60
CYP2C9 P11712 1/20 0.60
CYP2C19 P33261 1/20 0.60
KMT2A Q03164 7/20 0.56
MAPT P10636 3/20 0.56
GFER P55789 1/20 0.56
PRSS1 P07477 1/20 0.56
ACR P10323 1/20 0.56
CA1 P00915 2/20 0.56
CA2 P00918 2/20 0.56
NPC1 O15118 2/20 0.51
RAB9A P51151 2/20 0.51
KDM4E B2RXH2 1/20 0.50
ALDH1A1 P00352 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
CES2 O00748 1/20 0.50
CES1 P23141 1/20 0.50
ESR1 P03372 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
SCHEMBL12536667 1.00 SMN1; SMN2 (0.60) SMN1; SMN2LMNACYP1A2CYP2C9CYP2C19
SCHEMBL28646241 0.91 HSD17B10 (0.53) SMN1; SMN2LMNACYP1A2CYP2C9CYP2C19
SCHEMBL8961201 0.91 HSD17B10 (0.53) SMN1; SMN2LMNACYP1A2CYP2C9CYP2C19
SCHEMBL15373871 0.91 KMT2A (0.51) SMN1; SMN2LMNACYP1A2CYP2C9CYP2C19
SCHEMBL26079702 0.88 SMN1; SMN2 (0.62) SMN1; SMN2LMNACYP1A2CYP2C9CYP2C19
SCHEMBL8069410 0.88 SMN1; SMN2 (0.62) SMN1; SMN2LMNACYP1A2CYP2C9CYP2C19
SCHEMBL16749900 0.88 SMN1; SMN2 (0.62) SMN1; SMN2LMNACYP1A2CYP2C9CYP2C19
SCHEMBL12199927 0.88 SMN1; SMN2 (0.62) SMN1; SMN2LMNACYP1A2CYP2C9CYP2C19
SCHEMBL7591660 0.87 LMNA (0.75) SMN1; SMN2LMNACYP1A2CYP2C9CYP2C19
SCHEMBL12633724 0.87 LMNA (0.75) SMN1; SMN2LMNACYP1A2CYP2C9CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3049386-B9 COMPOUNDS USEFUL IN THE TREATMENT OF NEOPLASTIC DISEASES UNIV KOELN (DE) 2020-11-18 EP disclosed
US-10793509-B2 Compounds useful in the treatment of neoplastic diseases UNIVERSITÄT ZU KOLN (DE) 2020-10-06 US disclosed
EP-3049386-B1 COMPOUNDS USEFUL IN THE TREATMENT OF NEOPLASTIC DISEASES UNIV KOELN (DE) 2020-07-22 EP disclosed
US-20160237023-A1 COMPOUNDS USEFUL IN THE TREATMENT OF NEOPLASTIC DISEASES UNIVERSITÄT ZU KÖLN (DE) 2016-08-18 US disclosed
WO-2015044177-A1 COMPOUNDS USEFUL IN THE TREATMENT OF NEOPLASTIC DISEASES UNIVERSITÄT ZU KÖLN (DE) 2015-04-02 WO disclosed
US-20070173498-A1 Melanin concentrating hormone antagonist KATO KANEYOSHI 2007-07-26 US disclosed
US-7115750-B1 Melanin concentrating hormone antagonist TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-10-03 US disclosed
EP-1218336-A2 MELANIN CONCENTRATING HORMONE ANTAGONIST Takeda Chemical Industries, Ltd. (JP) 2002-07-03 EP disclosed
WO-2001021577-A2 MELANIN CONCENTRATING HORMONE ANTAGONIST TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-03-29 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 (3 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-20160237023-A1 COMPOUNDS USEFUL IN THE TREATMENT OF NEOPLASTIC DISEASES APC, BRCA1, VHL SMN1; SMN2 346/4885LMNA 1720/4885CYP1A2 1848/4885
US-10793509-B2 Compounds useful in the treatment of neoplastic diseases APC, BRCA1, VHL SMN1; SMN2 346/4885LMNA 1720/4885CYP1A2 1848/4885
US-20070173498-A1 Melanin concentrating hormone antagonist MC1R, MCHR1, MCHR2 SMN1; SMN2 3652/4885LMNA 4047/4885CYP1A2 1433/4885

“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.