SCHEMBL7793932

SCHEMBL7793932

COc1ccccc1N1CCN(C(C)=O)CC1

nearest known ligand 0.68

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 1/20 0.68
TSHR P16473 3/20 0.66
KMT2A Q03164 4/20 0.64
MEN1 O00255 3/20 0.64
POLB P06746 2/20 0.64
PKM P14618 1/20 0.64
HPGDS O60760 1/20 0.64
DRD2 P14416 1/20 0.63
DRD3 P35462 1/20 0.63
ALDH1A1 P00352 5/20 0.62
CYP1A2 P05177 1/20 0.62
CYP3A4 P08684 1/20 0.62
CYP2C9 P11712 1/20 0.62
CYP2C19 P33261 1/20 0.62
LMNA P02545 2/20 0.61
RAB9A P51151 1/20 0.61
SMN1; SMN2 Q16637 1/20 0.61
NPSR1 Q6W5P4 1/20 0.61
L3MBTL1 Q9Y468 1/20 0.60

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
SCHEMBL27829788 0.89 AKR1C3 (0.83) AKR1C3TSHRKMT2AMEN1POLB
SCHEMBL16026545 0.89 PKM (0.74) AKR1C3TSHRKMT2AMEN1POLB
SCHEMBL3904994 0.87 KMT2A (0.68) AKR1C3TSHRKMT2AMEN1POLB
SCHEMBL1423195 0.86 AKR1C3 (0.66) AKR1C3TSHRKMT2AMEN1POLB
SCHEMBL30747784 0.86 TSHR (0.68) AKR1C3TSHRKMT2AMEN1POLB
SCHEMBL8362372 0.86 TSHR (0.68) AKR1C3TSHRKMT2AMEN1POLB
SCHEMBL14344837 0.84 DRD2 (0.63) AKR1C3TSHRKMT2AMEN1POLB
SCHEMBL9272910 0.83 TSHR (0.64) AKR1C3TSHRKMT2AMEN1POLB
SCHEMBL14758395 0.83 ALDH1A1 (0.81) AKR1C3TSHRKMT2AMEN1POLB
SCHEMBL7572432 0.83 LMNA (0.65) AKR1C3TSHRKMT2AMEN1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3642209-B1 COMPOUNDS THAT INTERACT WITH THE RAS SUPERFAMILY FOR THE TREATMENT OF CANCERS, INFLAMMATORY DISEASES, RASOPATHIES, AND FIBROTIC DISEASE SHY Therapeutics LLC (US) 2023-11-29 EP disclosed
EP-3394056-B1 COMPOUNDS FOR THE TREATMENT OF CANCER AND INFLAMMATORY DISEASE SHY Therapeutics LLC (US) 2021-04-14 EP disclosed
US-9724381-B2 Methods of inhibiting the ghrelin/growth hormone secretatogue receptor pathway and uses thereof THE ADMINISTRATORS OF THE TULANE EDUCATIONAL FUND (US) 2017-08-08 US disclosed
WO-2017112777-A1 COMPOUNDS FOR THE TREATMENT OF CANCER AND INFLAMMATORY DISEASE SHY Therapeutics LLC (US) 2017-06-29 WO disclosed
US-20170049849-A9 METHODS OF INHIBITING THE GHRELIN/GROWTH HORMONE SECRETATOGUE RECEPTOR PATHWAY AND USES THEREOF THE ADMINISTRATORS OF THE TULANE EDUCATIONAL FUND (US) 2017-02-23 US disclosed
US-20150031605-A1 METHODS OF INHIBITING THE GHRELIN/GROWTH HORMONE SECRETATOGUE RECEPTOR PATHWAY AND USES THEREOF UNIV TULANE (US) 2015-01-29 US disclosed
US-8883721-B2 Methods of inhibiting the ghrelin/growth hormone secretatogue receptor pathway and uses thereof MCGILL UNIVERSITY (CA) 2014-11-11 US disclosed
US-8569267-B2 Tetracyclic tetrahydrofuran derivatives containing cyclic amine side chain JANSSEN PHARMACEUTICA, NV (BE) 2013-10-29 US disclosed
US-8536120-B2 Ghrelin/growth hormone releasing peptide/growth hormone secretatogue receptor antagonists and uses thereof THE ADMINISTRATORS OF THE TULANE EDUCATIONAL FUND (US) 2013-09-17 US disclosed
US-8536120-B2 Ghrelin/growth hormone releasing peptide/growth hormone secretatogue receptor antagonists and uses thereof THE ADMINISTRATORS OF THE TULANE EDUCATIONAL FUND (US) 2013-09-17 US disclosed
US-20080262076-A1 Novel Tetracyclic Tetrahydrofuran Derivatives Containing Cyclic Amine Side Chain JANSSEN PHARMACEUTICA, NV (BE) 2008-10-23 US disclosed
US-20080262076-A1 Novel Tetracyclic Tetrahydrofuran Derivatives Containing Cyclic Amine Side Chain JANSSEN PHARMACEUTICA, NV (BE) 2008-10-23 US disclosed
US-7332492-B2 Amino substituted dibenzothiophene derivatives for the treatment of disorders mediated by NP Y5 receptor ASTRAZENECA AB (SE) 2008-02-19 US disclosed
US-7332492-B2 Amino substituted dibenzothiophene derivatives for the treatment of disorders mediated by NP Y5 receptor ASTRAZENECA AB (SE) 2008-02-19 US disclosed
US-20070155813-A1 Hsp90 family protein inhibitors KYOWA HAKKO KOGYO CO., LTD. (JP) 2007-07-05 US disclosed
US-20070155813-A1 Hsp90 family protein inhibitors KYOWA HAKKO KOGYO CO., LTD. (JP) 2007-07-05 US disclosed
EP-0796251-B1 URACIL DERIVATIVES BYK GULDEN LOMBERG CHEM FAB (DE) 2001-10-17 EP disclosed
US-6046329-A Uracil derivatives BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 2000-04-04 US disclosed
EP-0796251-A1 URACIL DERIVATIVES Byk Gulden Lomberg Chemische Fabrik GmbH (DE) 1997-09-24 EP disclosed
WO-1996017831-A1 URACIL DERIVATIVES BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1996-06-13 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 (4 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-20080262076-A1 Novel Tetracyclic Tetrahydrofuran Derivatives Containing Cyclic Amine Side Chain HTR2C, HTR2A, HTR5A AKR1C3 1098/4885TSHR 179/4885KMT2A 1892/4885
US-20070155813-A1 Hsp90 family protein inhibitors HSP90AB1, HEATR1, HSP90AB2P AKR1C3 1516/4885TSHR 487/4885KMT2A 3994/4885
US-20150031605-A1 METHODS OF INHIBITING THE GHRELIN/GROWTH HORMONE SECRETATOGUE RECEPTOR PATHWAY AND USES THEREOF GHSR, GIPR, GHRHR AKR1C3 479/4885TSHR 22/4885KMT2A 3300/4885
US-20170049849-A9 METHODS OF INHIBITING THE GHRELIN/GROWTH HORMONE SECRETATOGUE RECEPTOR PATHWAY AND USES THEREOF GHSR, GIPR, GHRHR AKR1C3 479/4885TSHR 22/4885KMT2A 3300/4885

“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.