SCHEMBL21384392

SCHEMBL21384392

Cc1ccc(S(=O)(=O)O[C@H]2CCC3(C2)CN(C(=O)O)C3)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 2/20 0.48
CYP1A2 P05177 1/20 0.41
ALDH1A1 P00352 4/20 0.39
POLB P06746 2/20 0.39
NR1I2 O75469 1/20 0.39
RORC P51449 1/20 0.39
HPGD P15428 2/20 0.38
NPSR1 Q6W5P4 1/20 0.38
MMP2 P08253 6/20 0.37
TP53 P04637 1/20 0.37
CYP3A4 P08684 2/20 0.35
CYP2C19 P33261 2/20 0.35
FAAH O00519 1/20 0.35
MGLL Q99685 1/20 0.35
ABHD6 Q9BV23 1/20 0.35
CYP2C9 P11712 1/20 0.35
PKM P14618 1/20 0.35
ANPEP P15144 1/20 0.35
KMT2A Q03164 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL21682372 0.90 CYP2D6 (0.49) CYP2D6CYP1A2ALDH1A1HPGDNPSR1
SCHEMBL22915091 0.88 CYP2D6 (0.46) CYP2D6CYP1A2ALDH1A1POLBNPSR1
SCHEMBL21401566 0.88 CYP2D6 (0.46) CYP2D6CYP1A2ALDH1A1POLBNPSR1
SCHEMBL24802905 0.86 CYP2D6 (0.45) CYP2D6RORCTP53KMT2A
SCHEMBL751833 0.86 CYP2D6 (0.48) CYP2D6CYP1A2ALDH1A1POLBNR1I2
SCHEMBL23453563 0.79 CYP2D6 (0.49) CYP2D6CYP1A2RORCTP53KMT2A
SCHEMBL196226 0.78 CYP2D6 (0.67) CYP2D6CYP1A2ALDH1A1POLBHPGD
SCHEMBL21987575 0.78 CYP2D6 (0.55) CYP2D6CYP1A2ALDH1A1POLBHPGD
SCHEMBL21384491 0.78 ABHD6 (0.32) FAAHMGLLABHD6
SCHEMBL27129692 0.78 ABHD6 (0.32) FAAHMGLLABHD6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4219464-A1 PIPERAZINE AZASPIRO DERIVAVES Pfizer Inc. (US) 2023-08-02 EP disclosed
US-20230192654-A1 PIPERAZINE AZASPIRO DERIVATIVES PFIZER INC. 2023-06-22 US disclosed
EP-3768669-B1 PIPERAZINE AZASPIRO DERIVAVES PFIZER (US) 2023-01-25 EP disclosed
US-11524954-B2 Piperazine azaspiro derivatives PFIZER INC. (US) 2022-12-13 US disclosed
US-20210024497-A1 PIPERAZINE AZASPIRO DERIVAVES PFIZER INC. 2021-01-28 US disclosed
EP-3768669-A1 PIPERAZINE AZASPIRO DERIVAVES Pfizer Inc (US) 2021-01-27 EP disclosed
WO-2019183636-A1 PIPERAZINE AZASPIRO DERIVAVES PFIZER INC. (US) 2019-09-26 WO 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-20230192654-A1 PIPERAZINE AZASPIRO DERIVATIVES CHRM1, CHRM2, CHRM5 CYP2D6 360/4885CYP1A2 87/4885ALDH1A1 1350/4885
US-11524954-B2 Piperazine azaspiro derivatives CHRM1, CHRM2, CHRM5 CYP2D6 360/4885CYP1A2 87/4885ALDH1A1 1350/4885
US-20210024497-A1 PIPERAZINE AZASPIRO DERIVAVES CHRM1, CHRM2, CHRM5 CYP2D6 259/4885CYP1A2 78/4885ALDH1A1 906/4885

“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.