SCHEMBL23456329

SCHEMBL23456329

C[C@]12CCC(=O)C=C1CC[C@@H]1[C@@H]2[C@@H](OC(=O)CCC(=O)O)C[C@@]2(C)[C@H]1CC[C@]2(OC(=O)CCC(=O)O)C(=O)CO

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR3C2 P08235 8/20 0.70
PGR P06401 4/20 0.70
NR3C1 P04150 4/20 0.70
HIF1A Q16665 6/20 0.69
KMT2A Q03164 3/20 0.69
AR P10275 2/20 0.61
SMN1; SMN2 Q16637 3/20 0.56
CHRM1 P11229 1/20 0.56
CYP3A4 P08684 3/20 0.53
CYP2C19 P33261 2/20 0.53
HSD17B10 Q99714 2/20 0.53
MAPT P10636 2/20 0.53
SHBG P04278 1/20 0.53
SERPINA6 P08185 1/20 0.53
NFKB1 P19838 1/20 0.53
HPGD P15428 1/20 0.50
MEN1 O00255 1/20 0.50
MLNR O43193 1/20 0.50
NR1I2 O75469 1/20 0.50
LMNA P02545 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
SCHEMBL221482 0.90 NR3C2 (0.86) NR3C2PGRNR3C1HIF1AKMT2A
SCHEMBL29060653 0.90 NR3C2 (0.86) NR3C2PGRNR3C1HIF1AKMT2A
SCHEMBL122186 0.90 NR3C2 (0.79) NR3C2PGRNR3C1HIF1AKMT2A
SCHEMBL18506544 0.86 NR3C2 (0.68) NR3C2PGRNR3C1HIF1AKMT2A
SCHEMBL10597451 0.84 NR3C2 (0.87) NR3C2PGRNR3C1HIF1AKMT2A
SCHEMBL10597455 0.84 NR3C2 (0.87) NR3C2PGRNR3C1HIF1AKMT2A
SCHEMBL1030719 0.83 NR3C2 (0.74) NR3C2PGRNR3C1HIF1AKMT2A
Hydrocortisone Butyrate SCHEMBL14473210 0.83 NR3C2 (1.00) NR3C2PGRNR3C1HIF1AKMT2A
Hydrocortisone Butyrate SCHEMBL111478 0.83 NR3C2 (1.00) NR3C2PGRNR3C1HIF1AKMT2A
Hydrocortisone Butyrate SCHEMBL14936050 0.83 NR3C2 (1.00) NR3C2PGRNR3C1HIF1AKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240130980-A1 COMPOSITIONS FOR TREATING ACNE AND DERMATOLOGICAL CONDITIONS Ilera Derm LLC 2024-04-25 US disclosed
US-11931452-B2 Topical compositions containing rofecoxib and methods of making and using the same JF PHARMA TECH LLC (US) 2024-03-19 US disclosed
US-11890260-B2 Compositions for treating acne and dermatological conditions Ilera Derm LLC (US) 2024-02-06 US disclosed
EP-4153306-A1 COMPOSITIONS FOR TREATING ACNE AND DERMATOLOGICAL CONDITIONS Ilera Derm LLC (US) 2023-03-29 EP disclosed
US-20230025960-A1 TOPICAL COMPOSITIONS CONTAINING ROSE OIL AND CANNABIDIOL AND METHODS OF MAKING AND USING THE SAME JLABS Beauty LLC (US) 2023-01-26 US disclosed
US-11260023-B2 Topical compositions containing rofecoxib and methods of making and using the same BRIORI BIOTECH, LLC (US) 2022-03-01 US disclosed
US-20210361591-A1 COMPOSITIONS FOR TREATING ACNE AND DERMATOLOGICAL CONDITIONS Ilera Derm LLC 2021-11-25 US disclosed
WO-2021237214-A1 COMPOSITIONS FOR TREATING ACNE AND DERMATOLOGICAL CONDITIONS Ilera Derm LLC (US) 2021-11-25 WO disclosed
US-20210220259-A1 TOPICAL COMPOSITIONS CONTAINING ROFECOXIB AND METHODS OF MAKING AND USING THE SAME ESTRATO PHARMA INC 2021-07-22 US disclosed
WO-2021113083-A1 TOPICAL COMPOSITIONS CONTAINING ROSE OIL AND CANNABIDIOL AND METHODS OF MAKING AND USING THE SAME JLABS Beauty LLC (US) 2021-06-10 WO disclosed
US-20210169759-A1 TOPICAL COMPOSITIONS CONTAINING ROSE OIL AND CANNABIDIOL AND METHODS OF MAKING AND USING THE SAME JLABS Beauty LLC 2021-06-10 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 (5 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-11890260-B2 Compositions for treating acne and dermatological conditions COQ8A, ATP5ME, AGK NR3C2 4001/4885PGR 590/4885NR3C1 3071/4885
US-20230025960-A1 TOPICAL COMPOSITIONS CONTAINING ROSE OIL AND CANNABIDIOL AND METHODS OF MAKING AND USING THE SAME RXRG, CNR2, CUTA NR3C2 3311/4885PGR 1003/4885NR3C1 2774/4885
US-20210169759-A1 TOPICAL COMPOSITIONS CONTAINING ROSE OIL AND CANNABIDIOL AND METHODS OF MAKING AND USING THE SAME RXRG, CNR2, CUTA NR3C2 3311/4885PGR 1003/4885NR3C1 2774/4885
US-20210361591-A1 COMPOSITIONS FOR TREATING ACNE AND DERMATOLOGICAL CONDITIONS COQ8A, ATP5ME, AGK NR3C2 4001/4885PGR 590/4885NR3C1 3071/4885
US-20240130980-A1 COMPOSITIONS FOR TREATING ACNE AND DERMATOLOGICAL CONDITIONS COQ8A, ATP5ME, AGK NR3C2 4001/4885PGR 590/4885NR3C1 3071/4885

“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.