SCHEMBL20120398

SCHEMBL20120398

O=C(O)N1CCN(CCO[C@H]2C[C@@H](OCc3ccccc3)C2)CC1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
BCHE P06276 8/20 0.49
TEAD3 Q99594 1/20 0.47
TMEM97 Q5BJF2 1/20 0.45
CARM1 Q86X55 1/20 0.45
PRMT6 Q96LA8 1/20 0.45
SIGMAR1 Q99720 1/20 0.45
PRMT8 Q9NR22 1/20 0.45
HRH3 Q9Y5N1 1/20 0.45
ALDH1A1 P00352 2/20 0.44
LTA4H P09960 1/20 0.44
HTT P42858 1/20 0.44
MEN1 O00255 1/20 0.44
GAA P10253 1/20 0.44
KMT2A Q03164 1/20 0.44
PKM P14618 1/20 0.44
KCNA5 P22460 1/20 0.43
KDM4E B2RXH2 1/20 0.43

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
SCHEMBL20120400 1.00 BCHE (0.49) BCHETEAD3TMEM97CARM1PRMT6
SCHEMBL20120662 0.85 CHRM2 (0.46) BCHESIGMAR1
SCHEMBL20120659 0.85 CHRM2 (0.46) BCHESIGMAR1
SCHEMBL3828648 0.80 KDM4E (0.47) BCHEHRH3ALDH1A1KDM4E
SCHEMBL3828650 0.80 KDM4E (0.47) BCHEHRH3ALDH1A1KDM4E
SCHEMBL20120720 0.79 EPHX2 (0.49) BCHETEAD3SIGMAR1
SCHEMBL20120719 0.79 EPHX2 (0.49) BCHETEAD3SIGMAR1
SCHEMBL27143249 0.76 SMN1; SMN2 (0.55) BCHETEAD3MEN1KMT2A
SCHEMBL26037219 0.75 BCHE (0.47) BCHETEAD3TMEM97CARM1PRMT6
SCHEMBL2940477 0.74 CTSL (0.57) BCHETMEM97CARM1PRMT6SIGMAR1

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-20240217962-A1 TAU-PROTEIN TARGETING COMPOUNDS AND ASSOCIATED METHODS OF USE ARVINAS OPERATIONS, INC. 2024-07-04 US disclosed
US-11912699-B2 Tau-protein targeting compounds and associated ARVINAS OPERATIONS, INC. (US) 2024-02-27 US disclosed
US-20180125821-A1 TAU-PROTEIN TARGETING PROTACS AND ASSOCIATED METHODS OF USE ARVINAS OPERATIONS, INC. 2018-05-10 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 (3 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-11912699-B2 Tau-protein targeting compounds and associated MAPT, VHL, CRBN BCHE 1499/4885TEAD3 1776/4885TMEM97 2698/4885
US-20180125821-A1 TAU-PROTEIN TARGETING PROTACS AND ASSOCIATED METHODS OF USE CRBN, VHL, UBQLN2 BCHE 1930/4885TEAD3 2612/4885TMEM97 3460/4885
US-20240217962-A1 TAU-PROTEIN TARGETING COMPOUNDS AND ASSOCIATED METHODS OF USE VHL, CRBN, MAPT BCHE 1382/4885TEAD3 2405/4885TMEM97 2778/4885

“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.