SCHEMBL6323672

SCHEMBL6323672

CC(=O)OCC(=O)C1=CC[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)C(O)C[C@]12C

nearest known ligand 0.82

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 7/20 0.82
SMN1; SMN2 Q16637 3/20 0.82
HIF1A Q16665 10/20 0.63
CYP3A4 P08684 7/20 0.63
ALDH1A1 P00352 1/20 0.63
NR3C1 P04150 7/20 0.61
CYP2C9 P11712 3/20 0.61
CNR1 P21554 2/20 0.61
TBXA2R P21731 1/20 0.61
PGR P06401 5/20 0.55
NPSR1 Q6W5P4 2/20 0.55
MAPT P10636 2/20 0.55
KCNH2 Q12809 1/20 0.55
USP2 O75604 1/20 0.55
HSD17B10 Q99714 4/20 0.51
NFKB1 P19838 2/20 0.51
PMP22 Q01453 2/20 0.51
CYP2J2 P51589 1/20 0.51
BLM P54132 1/20 0.51
CYP2C19 P33261 1/20 0.51

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
SCHEMBL6323667 1.00 LMNA (0.82) LMNASMN1; SMN2HIF1ACYP3A4ALDH1A1
SCHEMBL11525651 1.00 LMNA (0.82) LMNASMN1; SMN2HIF1ACYP3A4ALDH1A1
SCHEMBL11054021 0.90 LMNA (1.00) LMNASMN1; SMN2HIF1ACYP3A4ALDH1A1
SCHEMBL11054037 0.90 LMNA (1.00) LMNASMN1; SMN2HIF1ACYP3A4ALDH1A1
SCHEMBL11054008 0.90 LMNA (1.00) LMNASMN1; SMN2HIF1ACYP3A4ALDH1A1
SCHEMBL11649313 0.88 LMNA (0.83) LMNASMN1; SMN2HIF1ACYP3A4ALDH1A1
SCHEMBL11649307 0.88 LMNA (0.83) LMNASMN1; SMN2HIF1ACYP3A4ALDH1A1
SCHEMBL11649309 0.88 LMNA (0.83) LMNASMN1; SMN2HIF1ACYP3A4ALDH1A1
SCHEMBL11407501 0.88 LMNA (0.64) LMNASMN1; SMN2HIF1ACYP3A4ALDH1A1
SCHEMBL11407499 0.88 LMNA (0.64) LMNASMN1; SMN2HIF1ACYP3A4ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050070515-A1 Compounds SMITHKLINE BEECHAM CORPORATION (US) 2005-03-31 US disclosed
EP-0998484-B1 METHOD OF IDENTIFYING COMPOUNDS HAVING REDUCED SYSTEMIC EFFECTS GLAXO GROUP LTD (GB) 2004-03-03 EP disclosed
US-20020019378-A1 COMPOUNDS GLAXO WELLCOME INC. 2002-02-14 US disclosed
EP-0998484-A1 THARAPEUTICALLY ACTIVE COMPOUNDS WITH LOW SYSTEMIC ACTIVITY DUE TO REDUCED HALF-LIFE GLAXO GROUP LIMITED (GB) 2000-05-10 EP disclosed
WO-1999001467-A2 THERAPEUTICALLY ACTIVE COMPOUNDS WITH LOW SYSTEMIC ACTIVITY DUE TO REDUCE HALF LIFE GLAXO GROUP LIMITED (GB) 1999-01-14 WO disclosed
US-4990612-A 16α-methylation process THE UPJOHN COMPANY (US) 1991-02-05 US disclosed
EP-0165037-B1 16 ALPHA-METHYL STEROIDS AND THEIR PREPARATION THE UPJOHN COMPANY (US) 1990-09-19 EP disclosed
US-4929395-A 16α-methylation process THE UPJOHN COMPANY (US) 1990-05-29 US disclosed
US-4891426-A EPOXIDATION WITH PERACID THE UPJOHN COMPANY (US) 1990-01-02 US disclosed
US-4704455-A 16α-methylatedΔ17(20)-corticoids THE UPJOHN COMPANY (US) 1987-11-03 US disclosed
EP-0165037-A2 16 alpha-methyl steroids and their preparation THE UPJOHN COMPANY (US) 1985-12-18 EP disclosed
US-4232013-A ANTIINFLAMMATORY AGENTS, RHEUMATISM LARK S.P.A. (IT) 1980-11-04 US disclosed
US-4155917-A WITH OZONE AND AN ALKANOL E. R. SQUIBB & SONS, INC. (US) 1979-05-22 US disclosed
EP-0000546-A1 D-homo oxasteroids, processes for their preparation, their use in preparing pharmaceutical compositions with antiinflammatocy activity and pharmaceutical compositions containing them E.R. Squibb & Sons, Inc. (US) 1979-02-07 EP disclosed
US-4116978-A ANTIINFLAMMATORY E. R. SQUIBB & SONS, INC. (US) 1978-09-26 US disclosed
US-4113722-A Steroidal[16α,17-b]benzodioxins E. R. SQUIBB & SONS, INC. (US) 1978-09-12 US disclosed
US-4018774-A ANTIINFLAMMATORY AGENTS E. R. SQUIBB & SONS, INC. (US) 1977-04-19 US disclosed
US-4018757-A ANTIINFLAMMATORY AGENTS E. R. SQUIBB & SONS, INC. (US) 1977-04-19 US disclosed
US-3937720-A ANTIINFLAMMATORY AGENTS E. R. SQUIBB & SONS, INC. (US) 1976-02-10 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-20020019378-A1 COMPOUNDS ATP6V1E1, PSME1, ATP6V1H LMNA 3880/4885SMN1; SMN2 3225/4885HIF1A 1534/4885
US-20050070515-A1 Compounds LCT, LPO, LIPE LMNA 3427/4885SMN1; SMN2 2435/4885HIF1A 3848/4885

“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.