SCHEMBL23456330

SCHEMBL23456330

C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)CC(OC(=O)CCC(=O)OC(=O)CCC(=O)O)[C@@]43C)[C@@H]1CC[C@]2(O)C(=O)CO

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HIF1A Q16665 13/20 0.59
▸ SMN1; SMN2 Q16637 3/20 0.59
▸ HSD17B10 Q99714 4/20 0.59
▸ NR3C1 P04150 4/20 0.59
▸ PGR P06401 4/20 0.59
▸ NR3C2 P08235 4/20 0.59
▸ CYP2C19 P33261 3/20 0.59
▸ SERPINA6 P08185 3/20 0.59
▸ CYP3A4 P08684 3/20 0.59
▸ KMT2A Q03164 3/20 0.59
▸ NFKB1 P19838 2/20 0.59
▸ MAPT P10636 2/20 0.59
▸ SHBG P04278 1/20 0.59
▸ AR P10275 2/20 0.54
▸ ABCB11 O95342 1/20 0.54
▸ TNF P01375 1/20 0.54
▸ IL6 P05231 1/20 0.54
▸ GLUL P15104 1/20 0.54
▸ ADAM17 P78536 1/20 0.54
▸ GPBAR1 Q8TDU6 1/20 0.54

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
SCHEMBL1301994 0.98 HIF1A (0.62) HIF1ASMN1; SMN2HSD17B10NR3C1PGR
SCHEMBL27941428 0.97 HIF1A (0.61) HIF1ASMN1; SMN2HSD17B10NR3C1PGR
SCHEMBL27571456 0.97 HIF1A (0.61) HIF1ASMN1; SMN2HSD17B10NR3C1PGR
SCHEMBL6001323 0.94 HIF1A (0.65) HIF1ASMN1; SMN2HSD17B10NR3C1PGR
SCHEMBL249836 0.94 HIF1A (0.64) HIF1ASMN1; SMN2HSD17B10NR3C1PGR
SCHEMBL14931695 0.94 HIF1A (0.64) HIF1ASMN1; SMN2HSD17B10NR3C1PGR
Propionic Acid SCHEMBL27929927 0.92 HIF1A (0.59) HIF1ASMN1; SMN2HSD17B10NR3C1PGR
Butyric Acid SCHEMBL28140488 0.92 HIF1A (0.59) HIF1ASMN1; SMN2HSD17B10NR3C1PGR
Butyric Acid SCHEMBL27495006 0.92 HIF1A (0.58) HIF1ASMN1; SMN2HSD17B10NR3C1PGR
SCHEMBL1535104 0.91 HIF1A (0.63) HIF1ASMN1; SMN2HSD17B10NR3C1PGR

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
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
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

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 HIF1A 1441/4885SMN1; SMN2 4647/4885HSD17B10 271/4885
US-20230025960-A1 TOPICAL COMPOSITIONS CONTAINING ROSE OIL AND CANNABIDIOL AND METHODS OF MAKING AND USING THE SAME RXRG, CNR2, CUTA HIF1A 1331/4885SMN1; SMN2 4015/4885HSD17B10 802/4885
US-20210169759-A1 TOPICAL COMPOSITIONS CONTAINING ROSE OIL AND CANNABIDIOL AND METHODS OF MAKING AND USING THE SAME RXRG, CNR2, CUTA HIF1A 1331/4885SMN1; SMN2 4015/4885HSD17B10 802/4885
US-20210361591-A1 COMPOSITIONS FOR TREATING ACNE AND DERMATOLOGICAL CONDITIONS COQ8A, ATP5ME, AGK HIF1A 1441/4885SMN1; SMN2 4647/4885HSD17B10 271/4885
US-20240130980-A1 COMPOSITIONS FOR TREATING ACNE AND DERMATOLOGICAL CONDITIONS COQ8A, ATP5ME, AGK HIF1A 1441/4885SMN1; SMN2 4647/4885HSD17B10 271/4885

“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.

Send feedback