SCHEMBL6905057

SCHEMBL6905057

CC1=C(C2=CCCCCC2)CCCCC1C

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.38
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA4 P22748 1/20 0.35
HDAC1 Q13547 1/20 0.32
HDAC2 Q92769 1/20 0.32
PSMB5 P28074 5/20 0.32
PSMB1 P20618 2/20 0.31
SMURF1 Q9HCE7 1/20 0.31
CSF1R P07333 1/20 0.31

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
SCHEMBL5775953 1.00 KMT2A (0.38) KMT2ACA1CA2CA4HDAC1
SCHEMBL849235 0.78 KMT2A (0.41) KMT2ACA1CA2CA4HDAC1
SCHEMBL24297812 0.77 HDAC1 (0.32) CA1CA2CA4HDAC1HDAC2
SCHEMBL8419979 0.77 HDAC1 (0.35) KMT2ACA1CA2CA4HDAC1
SCHEMBL28414825 0.75 PSMB5 (0.36) PSMB5PSMB1
SCHEMBL9419035 0.75 PSMB5 (0.36) PSMB5PSMB1
SCHEMBL29066344 0.73 NPC1 (0.33) PSMB5CSF1R
SCHEMBL20574040 0.73 HDAC1 (0.33) HDAC1HDAC2
SCHEMBL5075378 0.73 HDAC1 (0.33) HDAC1HDAC2
SCHEMBL2513476 0.71 HDAC1 (0.32) HDAC1HDAC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4581007-B1 DIMETHYLBICYCLOHEPTENYL AND DIMETHYLBICYCLOHEPTANYL DERIVATIVES AND THEIR USE AS ODORANTS GIVAUDAN SA (CH) 2026-05-27 EP disclosed
US-20260078080-A1 DIMETHYLBICYCLOHEPTENYL AND DIMETHYLBICYCLOHEPTANYL DERIVATIVES AND THEIR USE AS ODORANTS GIVAUDAN SA (CH) 2026-03-19 US disclosed
EP-4581007-A1 DIMETHYLBICYCLOHEPTENYL AND DIMETHYLBICYCLOHEPTANYL DERIVATIVES AND THEIR USE AS ODORANTS Givaudan SA (CH) 2025-07-09 EP disclosed
CN-119790032-A Dimethyl bicycloheptenyl and dimethyl bicycloheptyl derivatives and their use as flavouring agents 奇华顿股份有限公司 2025-04-08 CN disclosed
WO-2024045134-A1 ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2024-03-07 WO disclosed
WO-2024045134-A1 ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2024-03-07 WO disclosed
WO-2024047093-A1 DIMETHYLBICYCLOHEPTENYL AND DIMETHYLBICYCLOHEPTANYL DERIVATIVES AND THEIR USE AS ODORANTS GIVAUDAN SA (CH) 2024-03-07 WO disclosed
WO-2024047093-A1 DIMETHYLBICYCLOHEPTENYL AND DIMETHYLBICYCLOHEPTANYL DERIVATIVES AND THEIR USE AS ODORANTS GIVAUDAN SA (CH) 2024-03-07 WO disclosed
US-6703527-B2 REACTING ALLYL ALCOHOL COMPOUND SUCH AS 2E,6E-3,7,11-TRIMETHYL-2,6,10-DODECATRIEN-1-OL WITH HYDRIDE ACCEPTOR SUCH AS 2-NITROBENZALDEHYDE IN THE PRESENCE OF AN ALUMINIUM ALKOXIDE AS AN OPPENAUER OXIDATION CATALYST NIKKEN CHEMICALS CO., LTD. (JP) 2004-03-09 US disclosed
US-20020198411-A1 Method for oxidation of allyl alcohol NIKKEN CHEMICALS CO., LTD. (JP) 2002-12-26 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-20020198411-A1 Method for oxidation of allyl alcohol ADH1A, ADH1C, ADH5 KMT2A 750/4885CA1 1057/4885CA2 2553/4885
US-20260078080-A1 DIMETHYLBICYCLOHEPTENYL AND DIMETHYLBICYCLOHEPTANYL DERIVATIVES AND THEIR USE AS ODORANTS GALR1, GALK1, GALR2 KMT2A 3032/4885CA1 3191/4885CA2 4316/4885

“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.