SCHEMBL345875

SCHEMBL345875

CCOC(=O)c1ccc(-c2ccc(O)c(Br)c2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 5/20 0.59
CA2 P00918 5/20 0.59
CA12 O43570 4/20 0.59
CA7 P43166 4/20 0.59
CA9 Q16790 4/20 0.59
CA14 Q9ULX7 4/20 0.59
ESR1 P03372 2/20 0.57
ESR2 Q92731 1/20 0.56
HSD17B2 P37059 1/20 0.54
CYP1A2 P05177 2/20 0.50
LMNA P02545 1/20 0.50
CYP3A4 P08684 1/20 0.50
MAOA P21397 1/20 0.50
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
STS P08842 1/20 0.47
PDK2 Q15119 1/20 0.46
KDM4E B2RXH2 1/20 0.46
NPC1 O15118 1/20 0.46
ALDH1A1 P00352 1/20 0.46

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
SCHEMBL30016425 1.00 CA1 (0.59) CA1CA2CA12CA7CA9
SCHEMBL30812164 0.87 ESR1 (0.72) CA1CA2CA12CA7CA9
SCHEMBL2543424 0.87 ESR1 (0.72) CA1CA2CA12CA7CA9
SCHEMBL28659596 0.84 CA12 (0.63) CA1CA2CA12CA7CA9
SCHEMBL6399400 0.84 KMT2A (0.51) ESR1LMNAMEN1KMT2AKDM4E
SCHEMBL29644794 0.83 ERN1 (0.63) CA1CA2CA12CA7CA9
SCHEMBL27507237 0.83 ERN1 (0.63) CA1CA2CA12CA7CA9
SCHEMBL31347271 0.82 CA1 (0.59) CA1CA2CA12CA7CA9
SCHEMBL6939271 0.82 CA12 (0.59) CA1CA2CA12CA7CA9
SCHEMBL1965326 0.82 CA1 (0.73) CA1CA2CA12CA7CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240217992-A1 RETINOIC ACID RECEPTOR AGONIST, PREPARATION METHOD THEREFOR, INTERMEDIATE, PHARMACEUTICAL COMPOSITION AND USE Jiangxi Kerui Pharmaceutical Co., Ltd. (CN) 2024-07-04 US disclosed
US-20240217992-A1 RETINOIC ACID RECEPTOR AGONIST, PREPARATION METHOD THEREFOR, INTERMEDIATE, PHARMACEUTICAL COMPOSITION AND USE Jiangxi Kerui Pharmaceutical Co., Ltd. (CN) 2024-07-04 US disclosed
US-20240217992-A1 RETINOIC ACID RECEPTOR AGONIST, PREPARATION METHOD THEREFOR, INTERMEDIATE, PHARMACEUTICAL COMPOSITION AND USE Jiangxi Kerui Pharmaceutical Co., Ltd. (CN) 2024-07-04 US disclosed
EP-4332108-A1 RETINOIC ACID RECEPTOR AGONIST, PREPARATION METHOD THEREFOR, INTERMEDIATE, PHARMACEUTICAL COMPOSITION AND USE Jiangxi Kerui Pharmaceutical Co., Ltd. (CN) 2024-03-06 EP disclosed
WO-2022228409-A1 RETINOIC ACID RECEPTOR AGONIST, PREPARATION METHOD THEREFOR, INTERMEDIATE, PHARMACEUTICAL COMPOSITION AND USE 上海旭成医药科技有限公司 2022-11-03 WO disclosed
CN-115246856-A Retinoic acid receptor agonist, preparation method, intermediate, pharmaceutical composition and application thereof 上海旭成医药科技有限公司 2022-10-28 CN disclosed
US-8470871-B2 Ligands that modulate RAR receptors GALDERMA RESEARCH & DEVELOPMENT (FR) 2013-06-25 US disclosed
US-8362082-B2 Biphenyl compound selective agonists of gamma RAR receptors GALDERMA RESEARCH & DEVELOPMENT (FR) 2013-01-29 US disclosed
US-8362082-B2 Biphenyl compound selective agonists of gamma RAR receptors GALDERMA RESEARCH & DEVELOPMENT (FR) 2013-01-29 US disclosed
US-8362082-B2 Biphenyl compound selective agonists of gamma RAR receptors GALDERMA RESEARCH & DEVELOPMENT (FR) 2013-01-29 US disclosed
US-20090036536-A1 Biphenyl compound selective agonists of gamma RAR receptors GALDERMA RESEARCH & DEVELOPMENT (FR) 2009-02-05 US disclosed
US-20090036536-A1 Biphenyl compound selective agonists of gamma RAR receptors GALDERMA RESEARCH & DEVELOPMENT (FR) 2009-02-05 US disclosed
US-20090023811-A1 Biphenyl compound selective agonists of gamma RAR receptors GALDERMA RESEARCH & DEVELOPMENT (FR) 2009-01-22 US disclosed
US-20090023811-A1 Biphenyl compound selective agonists of gamma RAR receptors GALDERMA RESEARCH & DEVELOPMENT (FR) 2009-01-22 US disclosed
US-20090023811-A1 Biphenyl compound selective agonists of gamma RAR receptors GALDERMA RESEARCH & DEVELOPMENT (FR) 2009-01-22 US disclosed
US-20080015246-A1 Novel ligands that modulate RAR receptors and pharmaceutical/cosmetic compositions comprised thereof GALDERMA RESEARCH & DEVELOPMENT (FR) 2008-01-17 US disclosed
EP-1831149-A1 NOVEL LIGANDS THAT MODULATE RAR RECEPTORS AND USE THEREOF IN HUMAN MEDICINE AND IN COSMETICS GALDERMA RESEARCH & DEVELOPMENT (FR) 2007-09-12 EP disclosed
WO-2007068580-A1 BIPHENYL DERIVATIVES AS SELECTIVE AGONISTS OF GAMMA RAR RECEPTOR GALDERMA RESEARCH & DEVELOPMENT (FR) 2007-06-21 WO disclosed
WO-2007068579-A1 BIPHENYL DERIVATIVES AS SELECTIVE AGONISTS OF GAMMA RAR RECEPTORS GALDERMA RESEARCH & DEVELOPMENT (FR) 2007-06-21 WO disclosed
WO-2006066978-A1 NOVEL LIGANDS THAT MODULATE RAR RECEPTORS, AND USE THEREOF IN HUMAN MEDICINE AND IN COSMETICS GALDERMA RESEARCH & DEVELOPMENT (FR) 2006-06-29 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 (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-20090023811-A1 Biphenyl compound selective agonists of gamma RAR receptors RARG, RARB, RARA CA1 4849/4885CA2 4779/4885CA12 4816/4885
US-20240217992-A1 RETINOIC ACID RECEPTOR AGONIST, PREPARATION METHOD THEREFOR, INTERMEDIATE, PHARMACEUTICAL COMPOSITION AND USE RARA, RARG, RXRG CA1 4533/4885CA2 4249/4885CA12 3640/4885
US-20080015246-A1 Novel ligands that modulate RAR receptors and pharmaceutical/cosmetic compositions comprised thereof RARB, RARA, RARG CA1 4609/4885CA2 4037/4885CA12 4084/4885
US-20090036536-A1 Biphenyl compound selective agonists of gamma RAR receptors RARG, RARB, RARA CA1 4849/4885CA2 4779/4885CA12 4816/4885

“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.