SCHEMBL3326771

SCHEMBL3326771

COc1cccc(F)c1Oc1cc(Cl)ccc1O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CXCL12 P48061 2/20 0.43
▸ KMT2A Q03164 4/20 0.41
▸ KDM4E B2RXH2 4/20 0.41
▸ LMNA P02545 3/20 0.41
▸ GAA P10253 2/20 0.41
▸ KCNMA1 Q12791 1/20 0.41
▸ HIF1A Q16665 1/20 0.41
▸ AR P10275 2/20 0.41
▸ MAPT P10636 3/20 0.40
▸ TP53 P04637 2/20 0.40
▸ CA1 P00915 1/20 0.40
▸ CA2 P00918 1/20 0.40
▸ TSHR P16473 1/20 0.40
▸ SCN8A Q9UQD0 2/20 0.39
▸ SCN10A Q9Y5Y9 2/20 0.39
▸ MEN1 O00255 2/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ CYP3A4 P08684 2/20 0.39
▸ ALOX15 P16050 2/20 0.39
▸ CYP2C9 P11712 1/20 0.39

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
SCHEMBL3325788 0.80 ERN1 (0.41) KMT2ALMNAARMAPTSCN8A
SCHEMBL4504793 0.79 KDM4E (0.47) CXCL12KMT2AKDM4ELMNAKCNMA1
SCHEMBL363972 0.76 MAOB (0.61) CXCL12KMT2AARCA2TSHR
SCHEMBL19425624 0.75 SLC6A2 (0.50) CXCL12KMT2ALMNAKCNMA1AR
SCHEMBL2050136 0.74 HTR1A (0.41) KMT2AKDM4ELMNAGAAAR
Formaldehyde SCHEMBL27485393 0.71 MAOB (0.55) CXCL12KMT2AKCNMA1ARMEN1
SCHEMBL5990327 0.71 SCN8A (0.47) LMNAMAPTSCN8ASCN10AHPGD
SCHEMBL4508321 0.70 HTR2C (0.50) KMT2AKDM4ELMNAKCNMA1HIF1A
SCHEMBL5989716 0.70 HTR2C (0.48) KMT2AKDM4ELMNAKCNMA1MAPT
SCHEMBL15211455 0.70 TRPV4 (0.52) CXCL12KMT2ALMNAGAAMEN1

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-20100120858-A1 Piperidine Derivatives PFIZER INC. 2010-05-13 — — US disclosed
EP-2066630-A1 PIPERIDINE DERIVATIVES Pfizer Products Incorporated (US) 2009-06-10 — — EP disclosed
WO-2008023258-A1 PIPERIDINE DERIVATIVES PFIZER PRODUCTS INC. (US) 2008-02-28 — — 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 (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-20100120858-A1 Piperidine Derivatives P2RX5, P2RX7, P2RX1 CXCL12 1584/4885KMT2A 1140/4885KDM4E 2031/4885

“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.

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