SCHEMBL22233273

SCHEMBL22233273

C[C@H](NC(=O)O)C(=O)NC1CCNCC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 4/20 0.50
POLB P06746 1/20 0.46
TSHR P16473 2/20 0.40
HTT P42858 1/20 0.40
HSD17B10 Q99714 1/20 0.40
GNAI3 P08754 1/20 0.40
GNAO1 P09471 1/20 0.40
GNAI1 P63096 1/20 0.40
SMYD3 Q9H7B4 3/20 0.39
KDM1A O60341 1/20 0.38
HTR4 Q13639 2/20 0.37
EPHX2 P34913 1/20 0.37
SIGMAR1 Q99720 1/20 0.37
KMT2A Q03164 1/20 0.36
ALDH1A1 P00352 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
GABRP O00591 1/20 0.35
GABRD O14764 1/20 0.35
GABRA1 P14867 1/20 0.35
GABRB1 P18505 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
SCHEMBL19716609 1.00 EPHX1 (0.50) EPHX1POLBTSHRHTTHSD17B10
SCHEMBL22980054 0.84 SMN1; SMN2 (0.46) EPHX1TSHRHTTHSD17B10KDM1A
SCHEMBL22980056 0.84 SMN1; SMN2 (0.46) EPHX1TSHRHTTHSD17B10KDM1A
SCHEMBL15647903 0.84 SMN1; SMN2 (0.50) EPHX1TSHRHTTHSD17B10EPHX2
SCHEMBL5720771 0.82 TSHR (0.51) EPHX1TSHRHTTHSD17B10EPHX2
SCHEMBL255421 0.80 EPHX1 (0.59) EPHX1POLBGNAI3GNAO1GNAI1
SCHEMBL19734820 0.79 KMT2A (0.48) EPHX1POLBKMT2AGAA
SCHEMBL28737415 0.79 KMT2A (0.48) EPHX1POLBKMT2AGAA
SCHEMBL28895020 0.78 EPHX1 (0.57) EPHX1POLBGNAI3GNAO1GNAI1
SCHEMBL1802727 0.77 EPHX1 (0.55) EPHX1POLBGNAI3GNAO1GNAI1

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-20230159491-A1 Antimicrobial Compounds and Methods NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2023-05-25 US disclosed
EP-3911644-A1 ANTIMICROBIAL COMPOUNDS AND METHODS Curza Global LLC (US) 2021-11-24 EP disclosed
WO-2020150385-A1 ANTIMICROBIAL COMPOUNDS AND METHODS CURZA GLOBAL, LLC (US) 2020-07-23 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-20230159491-A1 Antimicrobial Compounds and Methods MPO, NISCH, RPN2 EPHX1 4311/4885POLB 108/4885TSHR 4733/4885

“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.