SCHEMBL19498129

SCHEMBL19498129

CCC1CCC2(CC1)CN(C(C)(C)C)C2

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.34
KDM4E B2RXH2 1/20 0.34
GAA P10253 1/20 0.34
HPGD P15428 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
POLB P06746 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
SCHEMBL13130983 0.87 GRIN2D (0.33) ALDH1A1KDM4EGAAHPGDSMN1; SMN2
SCHEMBL13130984 0.82 GRIN2D (0.38) ALDH1A1KDM4EGAAHPGDSMN1; SMN2
SCHEMBL13130981 0.80
SCHEMBL13130982 0.77 GRIN2D (0.33)
SCHEMBL18069333 0.77 KDM4E (0.37) ALDH1A1KDM4EGAAHPGDSMN1; SMN2
SCHEMBL18867903 0.77 KDM4E (0.37) KDM4E
SCHEMBL27027465 0.77 GPR119 (0.31)
SCHEMBL19498122 0.76 CHRM2 (0.30)
SCHEMBL24854052 0.75 CRHBP (0.31)
SCHEMBL21862348 0.75 CYP1A2 (0.40) ALDH1A1KDM4EGAAHPGDSMN1; SMN2

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
US-20240067633-A1 KETOHEXOKINASE INHIBITOR AND USE THEREOF XIZANG HAISCO PHARMACEUTICAL CO., LTD. (CN) 2024-02-29 US disclosed
US-11584743-B2 Indole derivatives as estrogen receptor degraders ARVINAS OPERATIONS, INC. (US) 2023-02-21 US disclosed
US-20210040081-A1 INDOLE DERIVATIVES AS ESTROGEN RECEPTOR DEGRADERS Arvinas, Inc. 2021-02-11 US disclosed
US-20170305922-A1 CARM1 INHIBITORS AND USES THEREOF Epizyme, Inc. (US) 2017-10-26 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 (4 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-20210040081-A1 INDOLE DERIVATIVES AS ESTROGEN RECEPTOR DEGRADERS ESR1, GPER1, ESR2 ALDH1A1 1117/4885KDM4E 676/4885GAA 1316/4885
US-20170305922-A1 CARM1 INHIBITORS AND USES THEREOF CARM1, ADRM1, PRMT1 ALDH1A1 1286/4885KDM4E 892/4885GAA 1620/4885
US-11584743-B2 Indole derivatives as estrogen receptor degraders ESR1, GPER1, ESR2 ALDH1A1 1117/4885KDM4E 676/4885GAA 1316/4885
US-20240067633-A1 KETOHEXOKINASE INHIBITOR AND USE THEREOF KHK, GCK, HK1 ALDH1A1 710/4885KDM4E 911/4885GAA 179/4885

“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.