SCHEMBL1012463

SCHEMBL1012463

COC(=O)C1C(=O)CC2CCC1(C)N2Cc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FKBP1A P62942 1/20 0.45
SLC6A4 P31645 1/20 0.40
SLC6A3 Q01959 1/20 0.40
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
ALDH1A1 P00352 3/20 0.38
MAPT P10636 2/20 0.38
HPGD P15428 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
HSD17B10 Q99714 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
KMT2A Q03164 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL1011496 0.88 HSD11B1 (0.38) CYP2C9ALDH1A1KMT2A
SCHEMBL1012740 0.74 ELANE (0.37) NPSR1KMT2A
SCHEMBL1012336 0.73 ACE (0.37) CYP2C9CYP2C19ALDH1A1
SCHEMBL1011495 0.72 SLC6A4 (0.54) FKBP1ASLC6A4SLC6A3ALDH1A1KMT2A
SCHEMBL1010268 0.72 CHRM2 (0.36) ALDH1A1NPSR1KMT2A
SCHEMBL1015012 0.72 SLC6A4 (0.54) FKBP1ASLC6A4SLC6A3ALDH1A1KMT2A
SCHEMBL11099774 0.72 GRM6 (0.40) KMT2A
SCHEMBL1011462 0.70 ABL1 (0.40) ALDH1A1MAPTHPGDHSD17B10KMT2A
SCHEMBL22004724 0.70 FKBP1A (0.47) FKBP1ACYP2C9CYP2C19ALDH1A1MAPT
SCHEMBL1012462 0.68 HSD11B1 (0.40) ALDH1A1TDP1KMT2A

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
EP-1118674-B1 PROCESS FOR PRODUCING OPTICALLY ACTIVE TROPINONE MONOCARBOXYLIC ACID DERIVATIVE NIHON MEDIPHYSICS CO LTD (JP) 2011-01-05 EP disclosed
US-20030065183-A1 Process for producing optically active tropinonemonocarboxylic acid ester derivative NIHON MEDI-PHYSICS CO., LTD. 2003-04-03 US disclosed
US-6486323-B1 Process for producing optically active tropinonemonocarboxylic acid derivative NIHON MEDI-PHYSICS CO., LTD. (JP) 2002-11-26 US disclosed
EP-1118674-A1 PROCESS FOR PRODUCING OPTICALLY ACTIVE TROPINONE MONOCARBOXYLIC ACID DERIVATIVE Nihon Medi-Physics Co., Ltd. (JP) 2001-07-25 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 (1 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-20030065183-A1 Process for producing optically active tropinonemonocarboxylic acid ester derivative CES2, FTO, HAAO FKBP1A 2654/4885SLC6A4 1204/4885SLC6A3 712/4885

“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.