SCHEMBL14768435

SCHEMBL14768435

CC(C)N1CCCC2(CCCC2)CC1

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 6/20 0.39
HRH3 Q9Y5N1 4/20 0.35
CHRNA7 P36544 1/20 0.31
CYP1A2 P05177 6/20 0.31
CYP2C9 P11712 4/20 0.31
TSHR P16473 4/20 0.31
CYP3A4 P08684 3/20 0.31
CYP2C19 P33261 3/20 0.31
USP2 O75604 2/20 0.31
MAPK1 P28482 1/20 0.31
ALDH1A1 P00352 2/20 0.31
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
LMNA P02545 1/20 0.31
POLB P06746 1/20 0.31
MAPT P10636 1/20 0.31
BLM P54132 1/20 0.31
KMT2A Q03164 1/20 0.31
VCP P55072 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
SCHEMBL12911786 0.98 CYP2D6 (0.38) CYP2D6HRH3CHRNA7CYP1A2CYP2C9
SCHEMBL19194777 0.95 CYP2D6 (0.39) CYP2D6HRH3CHRNA7CYP1A2CYP2C9
SCHEMBL24576857 0.95 CYP2D6 (0.39) CYP2D6HRH3CHRNA7CYP1A2CYP2C9
SCHEMBL10254913 0.95 CYP2D6 (0.42) CYP2D6HRH3CHRNA7CYP1A2CYP2C9
SCHEMBL19194778 0.93 CYP2D6 (0.38) CYP2D6HRH3CHRNA7CYP1A2CYP2C9
SCHEMBL12911789 0.93 CYP2D6 (0.41) CYP2D6HRH3CHRNA7CYP1A2CYP2C9
SCHEMBL12890875 0.90 CYP2D6 (0.42) CYP2D6HRH3CHRNA7CYP1A2CYP2C9
SCHEMBL10111445 0.87 CYP2D6 (0.46) CYP2D6HRH3CHRNA7CYP1A2CYP2C9
SCHEMBL10111444 0.86 CYP2D6 (0.39) CYP2D6HRH3CYP1A2CYP2C9TSHR
SCHEMBL7770721 0.85 CYP2D6 (0.45) CYP2D6HRH3CHRNA7CYP1A2CYP2C9

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
WO-2022136509-A1 PYRAZOLOTHIAZOLE CARBOXAMIDES AND THEIR USES AS PDGFR INHIBITORS ACTELION PHARMACEUTICALS LTD (CH) 2022-06-30 WO disclosed
US-9682991-B2 Tricyclic compounds for use as kinase inhibitors FUNDACIÓN CENTRO NACIONAL DE INVESTIGACIONES ONCOLOGICAS CARLOS III (ES) 2017-06-20 US disclosed
US-9682991-B2 Tricyclic compounds for use as kinase inhibitors FUNDACIÓN CENTRO NACIONAL DE INVESTIGACIONES ONCOLOGICAS CARLOS III (ES) 2017-06-20 US disclosed
US-20130065881-A1 Tricyclic Compounds for Use as Kinase Inhibitors CENTRO NACIONAL DE INVESTIGACIONES ONCOLOGICAS (ES) 2013-03-14 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 (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-20130065881-A1 Tricyclic Compounds for Use as Kinase Inhibitors PIM1, PIM2, PIM3 CYP2D6 1321/4885HRH3 2576/4885CHRNA7 4789/4885

“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.