SCHEMBL5692162

SCHEMBL5692162

CC1(C)COCN1Cc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.41
ELANE P08246 2/20 0.41
SIGMAR1 Q99720 1/20 0.39
CTSG P08311 1/20 0.39
PRTN3 P24158 1/20 0.39
CYP3A4 P08684 1/20 0.39
HSD17B10 Q99714 1/20 0.39
MEN1 O00255 2/20 0.38
TSHR P16473 2/20 0.38
KMT2A Q03164 2/20 0.38
AMPD2 Q01433 2/20 0.38
MC4R P32245 1/20 0.38
CYP19A1 P11511 1/20 0.37
LMNA P02545 1/20 0.37
POLB P06746 1/20 0.37
OPRL1 P41146 1/20 0.37
ALDH1A1 P00352 2/20 0.36
TDP1 Q9NUW8 1/20 0.36
ACHE P22303 1/20 0.36
DRD2 P14416 1/20 0.36

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
SCHEMBL6132960 0.83 JAK2 (0.44) GAAELANESIGMAR1CYP3A4HSD17B10
SCHEMBL17700194 0.77 GAA (0.53) GAAELANESIGMAR1CTSGPRTN3
SCHEMBL16399787 0.73 ACHE (0.39) GAAELANEAMPD2ACHE
SCHEMBL17691233 0.70 AMPD2 (0.39) GAAELANESIGMAR1CYP3A4MEN1
SCHEMBL25219384 0.70 SIGMAR1 (0.39) SIGMAR1POLBDRD2DRD4DRD3
SCHEMBL21192985 0.70 SIGMAR1 (0.39) SIGMAR1POLBDRD2DRD4DRD3
SCHEMBL25226653 0.70 SIGMAR1 (0.39) SIGMAR1POLBDRD2DRD4DRD3
SCHEMBL6132736 0.70 GAA (0.44) GAAELANESIGMAR1CTSGPRTN3
SCHEMBL11018891 0.70 SIGMAR1 (0.47) SIGMAR1MEN1TSHRKMT2ALMNA
SCHEMBL9891029 0.69

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060270847-A1 Process for producing nitrogenous heterocyclic compound TORAY FINE CHEMICALS CO., LTD. (JP) 2006-11-30 US disclosed
EP-1640364-A1 PROCESS FOR PRODUCING NITROGENOUS HETEROCYCLIC COMPOUND Toray Fine Chemicals Co., Ltd. (JP) 2006-03-29 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-20060270847-A1 Process for producing nitrogenous heterocyclic compound HNMT, HRH4, QDPR GAA 3848/4885ELANE 3040/4885SIGMAR1 185/4885

“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.