SCHEMBL14224547

SCHEMBL14224547

CCC(=O)N[C@@H](CO)c1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 1/20 0.62
LMNA P02545 2/20 0.51
POLB P06746 1/20 0.51
ALDH1A1 P00352 2/20 0.51
GPR88 Q9GZN0 7/20 0.51
EPHX2 P34913 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
METAP2 P50579 2/20 0.49
METAP1 P53582 2/20 0.49
MAPK13 O15264 1/20 0.49
ROCK2 O75116 1/20 0.49
RPS6KA5 O75582 1/20 0.49
MAP4K4 O95819 1/20 0.49
PAK4 O96013 1/20 0.49
PRKCG P05129 1/20 0.49
CDK1 P06493 1/20 0.49
PRKACA P17612 1/20 0.49
RPS6KB1 P23443 1/20 0.49
CDK2 P24941 1/20 0.49
MAPK1 P28482 1/20 0.49

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
SCHEMBL14224491 1.00 RIPK1 (0.62) RIPK1LMNAPOLBALDH1A1GPR88
SCHEMBL14701528 0.87 ALDH1A1 (0.59) LMNAPOLBALDH1A1EPHX2SMN1; SMN2
SCHEMBL14535420 0.87 ALDH1A1 (0.59) LMNAPOLBALDH1A1EPHX2SMN1; SMN2
SCHEMBL4337456 0.87 RIPK1 (0.58) RIPK1LMNAALDH1A1GPR88EPHX2
SCHEMBL16901651 0.86 ROCK1 (0.51) RIPK1LMNAPOLBALDH1A1SMN1; SMN2
SCHEMBL6857593 0.86 SMN1; SMN2 (0.64) LMNAPOLBALDH1A1SMN1; SMN2HTT
SCHEMBL18832653 0.84 RIPK1 (0.55) RIPK1LMNAALDH1A1GPR88EPHX2
SCHEMBL14224780 0.83 KMT2A (0.47) RIPK1LMNAALDH1A1SMN1; SMN2HTT
SCHEMBL686783 0.83 SMN1; SMN2 (0.54) RIPK1LMNAPOLBALDH1A1SMN1; SMN2
SCHEMBL31037004 0.83 SLC6A9 (0.47) RIPK1LMNAALDH1A1SMN1; SMN2HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11358936-B2 Lysyl oxidase-like 2 inhibitors and uses thereof PHARMAKEA, INC. (US) 2022-06-14 US disclosed
US-20210171465-A1 LYSYL OXIDASE-LIKE 2 INHIBITORS AND USES THEREOF PHARMAKEA INC (US) 2021-06-10 US disclosed
US-10766860-B2 Lysyl oxidase-like 2 inhibitors and uses thereof PHARMAKEA, INC. (US) 2020-09-08 US disclosed
US-20180057458-A1 LYSYL OXIDASE-LIKE 2 INHIBITORS AND USES THEREOF PHARMAKEA, INC. 2018-03-01 US disclosed
WO-2017003862-A1 LYSYL OXIDASE-LIKE 2 INHIBITORS AND USES THEREOF PHARMAKEA, INC. (US) 2017-01-05 WO disclosed
US-7354919-B2 Isoxazole compositions useful as inhibitors of ERK VERTEX PHARMACEUTICALS INCORPORATED (US) 2008-04-08 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 (4 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-11358936-B2 Lysyl oxidase-like 2 inhibitors and uses thereof LOXL2, LOXL1, LOX RIPK1 2889/4885LMNA 179/4885POLB 1012/4885
US-20210171465-A1 LYSYL OXIDASE-LIKE 2 INHIBITORS AND USES THEREOF LOXL2, LOXL1, LOX RIPK1 2889/4885LMNA 179/4885POLB 1012/4885
US-10766860-B2 Lysyl oxidase-like 2 inhibitors and uses thereof LOXL2, LOXL1, LOX RIPK1 2889/4885LMNA 179/4885POLB 1012/4885
US-20180057458-A1 LYSYL OXIDASE-LIKE 2 INHIBITORS AND USES THEREOF LOXL2, LOXL1, LOX RIPK1 2889/4885LMNA 179/4885POLB 1012/4885

“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.