SCHEMBL9813666

SCHEMBL9813666

O=C1OCC1C1CCCCC1

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.33
ALDH1A1 P00352 2/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
HPGD P15428 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
SCHEMBL9813669 0.98 ALDH1A1 (0.33) MAPTALDH1A1MEN1KMT2AHPGD
SCHEMBL21500482 0.84 MAPT (0.32) MAPTALDH1A1
SCHEMBL20715355 0.84 MAPT (0.32) MAPTALDH1A1
SCHEMBL20715354 0.84 MAPT (0.32) MAPTALDH1A1
SCHEMBL6445720 0.84 MAPT (0.32) MAPTALDH1A1
SCHEMBL20715180 0.81 ALDH1A1 (0.32) ALDH1A1
SCHEMBL8815894 0.81 ALDH1A1 (0.32) ALDH1A1
SCHEMBL8444553 0.81 ALDH1A1 (0.32) ALDH1A1
SCHEMBL6383420 0.81 ALDH1A1 (0.32) ALDH1A1
SCHEMBL16116751 0.81 ALDH1A1 (0.32) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118266619-A Electronic cigarette tobacco tar and electronic cigarette 比亚迪精密制造有限公司 2024-07-02 CN disclosed
EP-0219199-B1 METHOD FOR PREPARATION OF LACTONES COULSTON INTERNATIONAL CORPORATION (US) 1991-07-31 EP disclosed
US-4772728-A AND ALDEHYDE ANGUS CHEMICAL COMPANY (US) 1988-09-20 US disclosed
EP-0219199-A1 Method for preparation of lactones COULSTON INTERNATIONAL CORPORATION (US) 1987-04-22 EP disclosed