SCHEMBL19083894

SCHEMBL19083894

CC1CCN(Cc2cc(Cl)cc(C(F)(F)F)c2)CC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 3/20 0.50
HRH3 Q9Y5N1 2/20 0.50
KCNH2 Q12809 1/20 0.44
CACNA1I Q9P0X4 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2D6 P10635 1/20 0.44
ALDH1A1 P00352 3/20 0.43
CNR2 P34972 1/20 0.43
USP2 O75604 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2C19 P33261 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
KDM4E B2RXH2 2/20 0.42
FAAH O00519 1/20 0.42
BCHE P06276 1/20 0.41
BACE1 P56817 1/20 0.41
GAA P10253 1/20 0.41
SIGMAR1 Q99720 1/20 0.41
UBE2M P61081 1/20 0.41
DCUN1D1 Q96GG9 1/20 0.41

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
SCHEMBL19075613 0.86 MGAT2 (0.45) ACHEKCNH2CACNA1ICYP3A4CYP2D6
SCHEMBL21075596 0.85 KCNH2 (0.42) ACHEKCNH2CACNA1ICYP3A4CYP2D6
SCHEMBL18908952 0.85 ACHE (0.62) ACHEHRH3KCNH2CACNA1ICYP2D6
SCHEMBL19083789 0.81 ALDH1A1 (0.48) ACHEHRH3ALDH1A1L3MBTL1BCHE
SCHEMBL14242820 0.80 HRH3 (0.67) ACHEHRH3KCNH2CYP3A4ALDH1A1
Ammonia Solution, Strong SCHEMBL28813879 0.79 HRH3 (0.65) ACHEHRH3KCNH2CYP3A4ALDH1A1
SCHEMBL19083685 0.79 CYP2D6 (0.52) KCNH2CYP3A4CYP2D6ALDH1A1USP2
SCHEMBL14708571 0.78 KDM4E (0.68) ACHEKCNH2CACNA1ICYP3A4ALDH1A1
SCHEMBL19084132 0.78 CYP2D6 (0.51) KCNH2CYP3A4CYP2D6ALDH1A1USP2
SCHEMBL23118445 0.77 CYP2D6 (0.50) KCNH2CYP3A4CYP2D6ALDH1A1USP2

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
EP-3166939-B1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF GENENTECH INC (US) 2019-06-05 EP disclosed
US-20170190662-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2017-07-06 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-20170190662-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF RDX, C1R, MTX1 ACHE 1652/4885HRH3 1260/4885KCNH2 1406/4885

“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.