SCHEMBL1022290

SCHEMBL1022290

CC1(C)CCC(C)(C)c2cc(S(=O)(=O)Cl)ccc21

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP26B1 Q9NR63 5/20 0.50
CYP26A1 O43174 7/20 0.47
RXRA P19793 10/20 0.42
RXRB P28702 10/20 0.42
RXRG P48443 8/20 0.42
RARB P10826 7/20 0.42
RARG P13631 7/20 0.42
RARA P10276 5/20 0.41
CYP3A4 P08684 1/20 0.40
CRABP2 P29373 1/20 0.40

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
SCHEMBL1743105 0.81 CYP26B1 (0.50) CYP26B1CYP26A1RXRARXRBRXRG
SCHEMBL15209657 0.81 KDM1A (0.37) CYP26B1CYP26A1RXRARXRBRXRG
SCHEMBL12878863 0.78 CA12 (0.40) CYP26B1RXRARXRBRXRGCYP3A4
SCHEMBL6472698 0.77 CYP26B1 (0.47) CYP26B1CYP26A1RXRARXRBRXRG
SCHEMBL6473308 0.77 CYP26B1 (0.47) CYP26B1CYP26A1RXRARXRBRXRG
SCHEMBL15805655 0.77 RARB (0.47) CYP26B1CYP26A1RXRARXRBRXRG
SCHEMBL17049099 0.73 RXRA (0.68) CYP26B1CYP26A1RXRARXRBRXRG
SCHEMBL7723491 0.73 RXRA (0.69) CYP26B1CYP26A1RXRARXRBRXRG
SCHEMBL5656647 0.73 NOTUM (0.44) CYP26B1CYP26A1RXRARARBRARG
SCHEMBL24259942 0.72 CYP26B1 (0.57) CYP26B1CYP26A1RXRARXRBRXRG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11364220-B2 Compounds and methods for inhibiting CPY26 enzymes QUEEN'S UNIVERSITY AT KINGSTON (CA) 2022-06-21 US disclosed
US-20210220326-A1 Compounds and Methods for Inhibiting CPY26 Enzymes QUEEN'S UNIVERSITY AT KINGSTON (CA) 2021-07-22 US disclosed
US-10874634-B2 Compounds and methods for inhibiting CYP26 enzymes QUEEN'S UNIVERSITY AT KINGSTON (CA) 2020-12-29 US disclosed
EP-2188272-B1 PHENYL- AND BENZYLTHIAZOLYLPIPERAZINE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES REMYND NV (BE) 2016-02-24 EP disclosed
US-8722681-B2 N-sulfonyl thiazolylpiperazine derivatives and related N-sulfonyl heterocyclic derivatives for the treatment of neuro degenerative diseases NV REMYND (BE) 2014-05-13 US disclosed
US-8541406-B2 Thiadiazole derivatives for the treatment of neurodegenerative diseases NV REMYND (BE) 2013-09-24 US disclosed
US-8436040-B2 Method of treating conditions involving PPAR-receptors with indole compounds LABORATOIRES FOURNIER S.A. (FR) 2013-05-07 US disclosed
CN-101378757-B Thiadiazole derivatives for the treatment of neuro degenerative diseases REMYND NV 2012-08-01 CN disclosed
US-8178699-B2 Modulators of CCR9 receptor and methods of use thereof PFIZER INC. (US) 2012-05-15 US disclosed
US-8039501-B2 Synephrine derivatives useful as anti-inflammatory agents UNIVERSITEIT GENT (BE) 2011-10-18 US disclosed
EP-0638071-A1 HETEROCYCLIC CARBONIC ACID DERIVATIVES WHICH BIND TO RETINOID RECEPTORS (RAR). EISAI CO LTD (JP) 1995-02-15 EP disclosed
WO-1994014777-A1 HETEROCYCLIC CARBONIC ACID DERIVATIVES WHICH BIND TO RETINOID RECEPTORS (RAR) EISAI CO., LTD. (JP) 1994-07-07 WO disclosed
US-5248823-A Diphenylheteroalkyl derivatives, the preparation thereof and drugs and cosmetics prepared therefrom BASF AKTIENGESELLSCHAFT (DE) 1993-09-28 US disclosed
EP-0386452-B1 DIPHENYL HETEROALKYL DERIVATIVES, THEIR PREPARATION AND MEDICINAL AND COSMETIC PREPARATIONS PREPARED THEREFROM BASF Aktiengesellschaft (DE) 1993-09-22 EP disclosed
US-5225601-A Sulfur containing compounds for skin disorders BASF AKTIENGESELLSCHAFT (DE) 1993-07-06 US disclosed
EP-0386451-B1 OXYGEN-BEARING DIPHENYL HETEROALKANES, PROCESS FOR THEIR PREPARATION AND USE BASF Aktiengesellschaft (DE) 1993-04-28 EP disclosed
US-5128479-A Skin disorders, cosmetics BASF AKTIENGESELLSCHAFT (DE) 1992-07-07 US disclosed
US-5087743-A Treatment of skin disorders BASF AKTIENGESELLSCHAFT (DE) 1992-02-11 US disclosed
EP-0386451-A1 Oxygen-bearing diphenyl heteroalkanes, process for their preparation and use BASF Aktiengesellschaft (DE) 1990-09-12 EP disclosed
EP-0386452-A1 Diphenyl heteroalkyl derivatives, their preparation and medicinal and cosmetic preparations prepared therefrom BASF Aktiengesellschaft (DE) 1990-09-12 EP 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 (3 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-10874634-B2 Compounds and methods for inhibiting CYP26 enzymes CYP26B1, CYP2A6, CYP26A1 CYP26B1 1/4885CYP26A1 3/4885RXRA 12/4885
US-11364220-B2 Compounds and methods for inhibiting CPY26 enzymes CYP2A6, CYP27A1, CYP26B1 CYP26B1 3/4885CYP26A1 4/4885RXRA 37/4885
US-20210220326-A1 Compounds and Methods for Inhibiting CPY26 Enzymes CYP2A6, CYP27A1, CYP26B1 CYP26B1 3/4885CYP26A1 4/4885RXRA 24/4885

“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.