SCHEMBL856221

SCHEMBL856221

CC(O)c1ccc(COC2CCCCO2)o1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ KDM4C Q9H3R0 1/20 0.35
▸ NPC1 O15118 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ CREBBP Q92793 2/20 0.33
▸ EP300 Q09472 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ ICAM1 P05362 1/20 0.32
▸ SELE P16581 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ SLC6A3 Q01959 2/20 0.30
▸ ALOX5 P09917 1/20 0.30
▸ ALDH1A1 P00352 2/20 0.30
▸ HPGD P15428 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ GAA P10253 1/20 0.30

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
SCHEMBL854901 0.77 MEN1 (0.43) MEN1KMT2ANPC1RAB9ACREBBP
SCHEMBL20558246 0.75 KDM4C (0.39) MEN1KMT2AKDM4CNPC1RAB9A
SCHEMBL857006 0.74 ALDH1A1 (0.41) MEN1KMT2AKDM4CNPC1RAB9A
SCHEMBL12709547 0.70 P2RX3 (0.37) MEN1KMT2AKDM4CNPC1RAB9A
SCHEMBL14768555 0.70 USP2 (0.43) MEN1KMT2AKDM4CNPC1RAB9A
SCHEMBL6994576 0.70 MEN1 (0.40) MEN1KMT2AKDM4CNPC1RAB9A
SCHEMBL12738804 0.70 MEN1 (0.40) MEN1KMT2AKDM4CNPC1RAB9A
SCHEMBL12489688 0.70 MEN1 (0.40) MEN1KMT2AKDM4CNPC1RAB9A
SCHEMBL6994573 0.70 MEN1 (0.40) MEN1KMT2AKDM4CNPC1RAB9A
SCHEMBL4317051 0.69 ICAM1 (0.45) MEN1KMT2AKDM4CNPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113543782-B Pharmaceutical composition for preventing hair whitening and preventing or treating leukotrichia or vitiligo 仁荷大学校产学协力团 2024-01-16 — — CN claimed
US-20220000832-A1 Pharmaceutical Composition for Preventing Greying of Hair and Preventing or Treating Poliosis or Vitiligo INHA UNIVERSITY RESEARCH AND BUSINESS FOUNDATION (KR) 2022-01-06 — — US claimed
CN-113543782-A Pharmaceutical composition for preventing hair from whitening and preventing or treating leukotrichia or vitiligo 仁荷大学校产学协力团 2021-10-22 — — CN claimed
WO-2020159146-A1 PHARMACEUTICAL COMPOSITION FOR PREVENTING GREYING OF HAIR AND PREVENTING OR TREATING POLIOSISOR VITILIGO 인하대학교 산학협력단 2020-08-06 — — WO claimed
CN-113543782-B Pharmaceutical composition for preventing hair whitening and preventing or treating leukotrichia or vitiligo 仁荷大学校产学协力团 2024-01-16 — — CN disclosed
US-20220000832-A1 Pharmaceutical Composition for Preventing Greying of Hair and Preventing or Treating Poliosis or Vitiligo INHA UNIVERSITY RESEARCH AND BUSINESS FOUNDATION (KR) 2022-01-06 — — US disclosed
US-20220000832-A1 Pharmaceutical Composition for Preventing Greying of Hair and Preventing or Treating Poliosis or Vitiligo INHA UNIVERSITY RESEARCH AND BUSINESS FOUNDATION (KR) 2022-01-06 — — US disclosed
CN-113543782-A Pharmaceutical composition for preventing hair from whitening and preventing or treating leukotrichia or vitiligo 仁荷大学校产学协力团 2021-10-22 — — CN disclosed
WO-2020159146-A1 PHARMACEUTICAL COMPOSITION FOR PREVENTING GREYING OF HAIR AND PREVENTING OR TREATING POLIOSISOR VITILIGO 인하대학교 산학협력단 2020-08-06 — — WO disclosed
WO-2020159146-A1 PHARMACEUTICAL COMPOSITION FOR PREVENTING GREYING OF HAIR AND PREVENTING OR TREATING POLIOSISOR VITILIGO 인하대학교 산학협력단 2020-08-06 — — WO disclosed
EP-2440555-B1 FLUORINATED AMINOTRIAZOLE DERIVATIVES ACTELION PHARMACEUTICALS LTD (CH) 2016-05-18 — — EP disclosed
US-8580831-B2 Fluorinated aminotriazole derivatives ACTELION PHARMACEUTICALS LTD. (CH) 2013-11-12 — — US disclosed
US-8563714-B2 Bridged spiro [2.4] heptane derivatives as ALX receptor and/or FPRL2 agonists ACTELION PHARMACEUTICALS LTD. (CH) 2013-10-22 — — US disclosed
EP-2432760-B1 BRIDGED SPIRO [2.4] HEPTANE DERIVATIVES AS ALX RECEPTOR AND/OR FPRL2 AGONISTS ACTELION PHARMACEUTICALS LTD (CH) 2013-07-17 — — EP disclosed
US-20120115841-A1 BRIDGED SPIRO [2.4] HEPTANE DERIVATIVES AS ALX RECEPTOR AND/OR FPRL2 AGONISTS ACTELION PHARMACEUTICALS LTD. (CH) 2012-05-10 — — US disclosed
US-20120101138-A1 FLUORINATED AMINOTRIAZOLE DERIVATIVES IDORSIA PHARMACEUTICALS LTD (CH) 2012-04-26 — — US disclosed
EP-2440555-A1 FLUORINATED AMINOTRIAZOLE DERIVATIVES Actelion Pharmaceuticals Ltd. (CH) 2012-04-18 — — EP disclosed
EP-2432760-A1 BRIDGED SPIRO [2.4]HEPTANE DERIVATIVES AS ALX RECEPTOR AND/OR FPRL2 AGONISTS Actelion Pharmaceuticals Ltd. (CH) 2012-03-28 — — EP disclosed
WO-2010143116-A1 FLUORINATED AMINOTRIAZOLE DERIVATIVES ACTELION PHARMACEUTICALS LTD (CH) 2010-12-16 — — WO disclosed
WO-2010134014-A1 BRIDGED SPIRO [2.4] HEPTANE DERIVATIVES AS ALX RECEPTOR AND/OR FPRL2 AGONISTS ACTELION PHARMACEUTICALS LTD (CH) 2010-11-25 — — 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 (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-20120115841-A1 BRIDGED SPIRO [2.4] HEPTANE DERIVATIVES AS ALX RECEPTOR AND/OR FPRL2 AGONISTS FPR1, FPR2, FPR3 MEN1 4630/4885KMT2A 3813/4885KDM4C 4822/4885
US-20220000832-A1 Pharmaceutical Composition for Preventing Greying of Hair and Preventing or Treating Poliosis or Vitiligo TYR, MC1R, SDHB MEN1 1172/4885KMT2A 3291/4885KDM4C 3634/4885
US-20120101138-A1 FLUORINATED AMINOTRIAZOLE DERIVATIVES AFF1, SULT2A1, NAT1 MEN1 854/4885KMT2A 187/4885KDM4C 3252/4885

“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.

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