SCHEMBL19946992

SCHEMBL19946992

COC(=O)C(O)C[C@@H]1CCCN1C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 2/20 0.39
▸ ATM Q13315 1/20 0.39
▸ RAB9A P51151 1/20 0.38
▸ POLB P06746 1/20 0.38
▸ PEPD P12955 1/20 0.34
▸ ACE P12821 3/20 0.33
▸ REN P00797 2/20 0.33
▸ CHRNB2 P17787 1/20 0.33
▸ CHRNA5 P30532 1/20 0.33
▸ CHRNA7 P36544 1/20 0.33
▸ CHRNA4 P43681 1/20 0.33
▸ FFAR1 O14842 1/20 0.33
▸ XPNPEP1 Q9NQW7 1/20 0.33

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
SCHEMBL19947221 0.84 L3MBTL1 (0.38) L3MBTL1ATMRAB9APOLBACE
SCHEMBL19947204 0.84 L3MBTL1 (0.38) L3MBTL1ATMRAB9APOLBPEPD
SCHEMBL19965312 0.82 SMN1; SMN2 (0.42) —
SCHEMBL19963364 0.82 SMN1; SMN2 (0.42) —
SCHEMBL18281690 0.77 ATM (0.46) L3MBTL1ATM
SCHEMBL14668787 0.76 POLB (0.41) L3MBTL1RAB9APOLBPEPDACE
SCHEMBL29481523 0.74 POLB (0.42) L3MBTL1RAB9APOLBPEPDACE
SCHEMBL28153696 0.74 POLB (0.42) L3MBTL1RAB9APOLBFFAR1
SCHEMBL5643023 0.74 POLB (0.42) L3MBTL1RAB9APOLBFFAR1
SCHEMBL18281730 0.74 FFAR1 (0.46) FFAR1

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-10246462-B2 Chemokine receptor modulators and uses thereof FLX BIO, INC. (US) 2019-04-02 — — US disclosed
WO-2018049271-A1 CHEMOKINE RECEPTOR MODULATORS AND USES THEREOF FLX BIO, INC. (US) 2018-03-15 — — WO disclosed
US-20180072743-A1 CHEMOKINE RECEPTOR MODULATORS AND USES THEREOF RAPT THERAPEUTICS, INC. 2018-03-15 — — 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-10246462-B2 Chemokine receptor modulators and uses thereof ACKR3, CCR5, CXCR3 L3MBTL1 3976/4885ATM 4327/4885RAB9A 2121/4885
US-20180072743-A1 CHEMOKINE RECEPTOR MODULATORS AND USES THEREOF ACKR3, CCR5, CXCR3 L3MBTL1 3976/4885ATM 4327/4885RAB9A 2121/4885

“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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