SCHEMBL3402187

SCHEMBL3402187

O=CCCCCCCC=Cc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PAM P19021 1/20 0.47
HDAC1 Q13547 3/20 0.44
HDAC8 Q9BY41 3/20 0.44
HDAC3 O15379 2/20 0.44
HDAC4 P56524 2/20 0.44
HDAC7 Q8WUI4 2/20 0.44
HDAC2 Q92769 2/20 0.44
HDAC10 Q969S8 2/20 0.44
HDAC11 Q96DB2 2/20 0.44
HDAC6 Q9UBN7 2/20 0.44
HDAC9 Q9UKV0 2/20 0.44
HDAC5 Q9UQL6 2/20 0.44
TBXAS1 P24557 1/20 0.44
TRPA1 O75762 1/20 0.43
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
ALOX5 P09917 1/20 0.43
MAPK1 P28482 1/20 0.43
SIGMAR1 Q99720 2/20 0.43
IDO1 P14902 2/20 0.42

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
SCHEMBL9232461 1.00 PAM (0.47) PAMHDAC1HDAC8HDAC3HDAC4
SCHEMBL5485532 1.00 PAM (0.47) PAMHDAC1HDAC8HDAC3HDAC4
SCHEMBL1248561 1.00 PAM (0.47) PAMHDAC1HDAC8HDAC3HDAC4
SCHEMBL17746757 1.00 PAM (0.47) PAMHDAC1HDAC8HDAC3HDAC4
SCHEMBL1248562 1.00 PAM (0.47) PAMHDAC1HDAC8HDAC3HDAC4
SCHEMBL97135 0.98 PAM (0.48) PAMHDAC1HDAC8HDAC3HDAC4
SCHEMBL22245646 0.94 PAM (0.48) PAMHDAC1HDAC8HDAC3HDAC4
SCHEMBL97322 0.94 PAM (0.48) PAMHDAC1HDAC8HDAC3HDAC4
SCHEMBL3795388 0.89 SIGMAR1 (0.50) PAMHDAC1HDAC8HDAC3HDAC4
SCHEMBL2399949 0.85 PAM (0.52) PAMTRPA1ALDH1A1LMNAALOX5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12559703-B2 Fragrance composition GIVAUDAN SA (CH) 2026-02-24 US disclosed
US-20240390246-A1 IMPROVED PERFUME COMPOSITIONS COMPRISING SULFUR-CONTAINING PRO-FRAGRANCE COMPOUNDS FIRMENICH SA (CH) 2024-11-28 US disclosed
US-20240301319-A1 PERFUMING COMPOSITIONS FIRMNICH SA (CH) 2024-09-12 US disclosed
US-12018226-B2 Perfuming compositions FIRMENICH SA (CH) 2024-06-25 US disclosed
US-20230151305-A1 FRAGRANCE COMPOSITION SA, GIVAUDAN (CH) 2023-05-18 US disclosed
US-11427783-B2 Perfuming compositions FIRMENICH SA (CH) 2022-08-30 US disclosed
US-10806683-B2 Encapsulated perfume compositions GIVAUDAN SA (CH) 2020-10-20 US disclosed
US-20200325415-A1 PERFUMING COMPOSITIONS FIRMENICH SA (CH) 2020-10-15 US disclosed
US-10722857-B2 Encapsulated perfume compositions GIVAUDAN S.A. (CH) 2020-07-28 US disclosed
US-10537868-B2 Microcapsules GIVAUDAN S.A. (CH) 2020-01-21 US disclosed
WO-2016207179-A1 IMPROVEMENTS IN OR RELATING TO ENCAPSULATED PERFUME COMPOSITIONS GIVAUDAN SA (CH) 2016-12-29 WO disclosed
WO-2016207180-A1 IMPROVEMENTS IN OR RELATING TO ENCAPSULATED PERFUME COMPOSITIONS GIVAUDAN SA (CH) 2016-12-29 WO disclosed
EP-2875111-A1 COMPOSITIONS COMPRISING LIPASE AND METHODS OF USE THEREOF Novozymes A/S (DK) 2015-05-27 EP disclosed
WO-2013171241-A9 COMPOSITIONS COMPRISING LIPASE AND METHODS OF USE THEREOF NOVOZYMES A/S (DK) 2014-11-27 WO disclosed
WO-2013171241-A1 COMPOSITIONS COMPRISING LIPASE AND METHODS OF USE THEREOF NOVOZYMES A/S (DK) 2013-11-21 WO disclosed
EP-2262885-A1 TRIGGERED RELEASE SYSTEM Novozymes A/S (DK) 2010-12-22 EP disclosed
EP-2254982-A1 DETERGENT COMPOSITION COMPRISING A TRIGGERED RELEASE SYSTEM Unilever N.V. (NL) 2010-12-01 EP disclosed
WO-2009118329-A1 TRIGGERED RELEASE SYSTEM NOVOZYMES A/S (DK) 2009-10-01 WO disclosed
WO-2009118349-A1 DETERGENT COMPOSITION COMPRISING A TRIGGERED RELEASE SYSTEM UNILEVER NV (NL) 2009-10-01 WO disclosed
US-4791098-A 2-methyl-3-(p-methylphenyl)propionitrile, preparation and use thereof as scent BASF AKTIENGESELLSCHAFT (DE) 1988-12-13 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 (2 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-12559703-B2 Fragrance composition DHCR24, OPRD1, OR10J3 PAM 1647/4885HDAC1 1829/4885HDAC8 2245/4885
US-20240390246-A1 IMPROVED PERFUME COMPOSITIONS COMPRISING SULFUR-CONTAINING PRO-FRAGRANCE COMPOUNDS PHGDH, SORD, CTH PAM 918/4885HDAC1 2593/4885HDAC8 2397/4885

“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.