SCHEMBL19797933

SCHEMBL19797933

CC1CCC(N2CCN(C(C)(C)C)CC2)C1

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.35
KDM4E B2RXH2 3/20 0.34
TSHR P16473 1/20 0.33
ALOX15 P16050 1/20 0.33
SIGMAR1 Q99720 2/20 0.33
KDM2B Q8NHM5 1/20 0.32
HRH3 Q9Y5N1 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL24856272 0.88 KDM4E (0.43) ALDH1A1KDM4EALOX15SIGMAR1MEN1
SCHEMBL16254537 0.88 KDM4E (0.43) ALDH1A1KDM4EALOX15SIGMAR1MEN1
SCHEMBL19797927 0.85 SIGMAR1 (0.35) SIGMAR1HRH3
SCHEMBL14355437 0.85
SCHEMBL11916112 0.83 SIGMAR1 (0.42) ALDH1A1KDM4ETSHRALOX15SIGMAR1
SCHEMBL19936629 0.77 ALDH1A1 (0.37) ALDH1A1KDM4ETSHRALOX15KDM2B
SCHEMBL16675697 0.77 ALDH1A1 (0.37) ALDH1A1KDM4ETSHRALOX15KDM2B
SCHEMBL117945 0.76 SIGMAR1 (0.41) TSHRSIGMAR1MEN1KMT2A
SCHEMBL11916119 0.76 SIGMAR1 (0.37) ALDH1A1KDM4EALOX15SIGMAR1HRH3
SCHEMBL22995523 0.76 ALDH1A1 (0.39) ALDH1A1KDM4ETSHRALOX15KDM2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10202354-B2 Therapeutic compounds and uses thereof GENENTECH, INC. (US) 2019-02-12 US disclosed
US-20180022707-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2018-01-25 US disclosed
US-20180022707-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2018-01-25 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 (2 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-20180022707-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF KDM1B, KDM6B, KDM2B ALDH1A1 656/4885KDM4E 19/4885TSHR 4578/4885
US-10202354-B2 Therapeutic compounds and uses thereof KDM1B, KDM6B, KDM2B ALDH1A1 656/4885KDM4E 19/4885TSHR 4578/4885

“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.