SCHEMBL20768616

SCHEMBL20768616

CCC(C(=O)O)(c1ccc([C@H](N)CO)cc1)C(C)C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 2/20 0.38
CYP2C9 P11712 1/20 0.38
HIF1A Q16665 1/20 0.38
LMNA P02545 1/20 0.37
CYP1A2 P05177 2/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
RIPK1 Q13546 1/20 0.35
KIF11 P52732 4/20 0.35
ANPEP P15144 1/20 0.34
TACR1 P25103 1/20 0.33
SCN10A Q9Y5Y9 1/20 0.31
GRM8 O00222 1/20 0.31
GRM4 Q14833 1/20 0.31
GRB2 P62993 1/20 0.31
CFD P00746 1/20 0.30
F11 P03951 1/20 0.30
TPSB2 P20231 1/20 0.30
TRPA1 O75762 1/20 0.30
CACNA1G O43497 1/20 0.30

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
SCHEMBL20768647 0.80 MEN1 (0.38) CYP2D6CYP2C9HIF1ALMNACYP1A2
SCHEMBL20768591 0.79 LMNA (0.38) CYP2D6CYP2C9HIF1ALMNACYP1A2
SCHEMBL3726388 0.77 CYP1A2 (0.52) CYP2D6HIF1ACYP1A2MEN1KMT2A
SCHEMBL20768612 0.76 MAP4K4 (0.41) CYP2D6CYP2C9HIF1ALMNAKMT2A
SCHEMBL20768611 0.76 MAP4K4 (0.41) CYP2D6CYP2C9HIF1ALMNAKMT2A
SCHEMBL19332273 0.71 PTGS2 (0.55) CYP2C9LMNAMEN1KMT2A
SCHEMBL20768556 0.71 PTGS2 (0.55) CYP2C9LMNAMEN1KMT2A
SCHEMBL17085961 0.70 SCN10A (0.46) LMNAKIF11ANPEPSCN10A
SCHEMBL7761117 0.70 SCN10A (0.46) LMNAKIF11ANPEPSCN10A
SCHEMBL1444985 0.69 ANPEP (0.41) CYP2D6HIF1ACYP1A2ANPEPSCN10A

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
US-20230348386-A1 3-PHOSPHOGLYCERATE DEHYDROGENASE INHIBITORS AND USES THEREOF RAZE THERAPEUTICS, INC. 2023-11-02 US disclosed
EP-4234552-A2 3-PHOSPHOGLYCERATE DEHYDROGENASE INHIBITORS AND USES THEREOF Raze Therapeutics, Inc. (US) 2023-08-30 EP disclosed
EP-3426244-B1 3-PHOSPHOGLYCERATE DEHYDROGENASE INHIBITORS AND USES THEREOF RAZE THERAPEUTICS INC (US) 2023-06-07 EP disclosed
US-11535593-B2 3-phosphoglycerate dehydrogenase inhibitors and uses thereof RAZE THERAPEUTICS, INC. (US) 2022-12-27 US disclosed
US-20220017464-A1 3-PHOSPHOGLYCERATE DEHYDROGENASE INHIBITORS AND USES THEREOF RAZE THERAPEUTICS, INC. 2022-01-20 US disclosed
US-11014882-B2 3-phosphoglycerate dehydrogenase inhibitors and uses thereof RAZE THERAPEUTICS, INC. (US) 2021-05-25 US disclosed
US-20190071400-A1 3-PHOSPHOGLYCERATE DEHYDROGENASE INHIBITORS AND USES THEREOF RAZE THERAPEUTICS, INC. 2019-03-07 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 (5 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-20230348386-A1 3-PHOSPHOGLYCERATE DEHYDROGENASE INHIBITORS AND USES THEREOF PHGDH, G6PD, PGD CYP2D6 1356/4885CYP2C9 1790/4885HIF1A 1598/4885
US-11535593-B2 3-phosphoglycerate dehydrogenase inhibitors and uses thereof PHGDH, G6PD, PGD CYP2D6 1356/4885CYP2C9 1790/4885HIF1A 1598/4885
US-11014882-B2 3-phosphoglycerate dehydrogenase inhibitors and uses thereof PHGDH, G6PD, PGD CYP2D6 1356/4885CYP2C9 1790/4885HIF1A 1598/4885
US-20190071400-A1 3-PHOSPHOGLYCERATE DEHYDROGENASE INHIBITORS AND USES THEREOF PHGDH, G6PD, PGD CYP2D6 1356/4885CYP2C9 1790/4885HIF1A 1598/4885
US-20220017464-A1 3-PHOSPHOGLYCERATE DEHYDROGENASE INHIBITORS AND USES THEREOF PHGDH, G6PD, PGD CYP2D6 1356/4885CYP2C9 1790/4885HIF1A 1598/4885

“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.