SCHEMBL21853251

SCHEMBL21853251

O=C(Oc1ccccn1)[C@@H]1CCCN1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ELANE P08246 1/20 0.42
▸ HRH3 Q9Y5N1 1/20 0.40
▸ HTR2C P28335 2/20 0.39
▸ HTR2B P41595 1/20 0.39
▸ SCN4A P35499 1/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ CYP2D6 P10635 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ DPP4 P27487 3/20 0.37
▸ DPP8 Q6V1X1 1/20 0.37
▸ ANPEP P15144 1/20 0.36
▸ PKM P14618 1/20 0.36
▸ CTSC P53634 1/20 0.36
▸ CHRNB2 P17787 2/20 0.35
▸ CHRNA4 P43681 2/20 0.35
▸ IDO1 P14902 1/20 0.35
▸ FURIN P09958 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
SCHEMBL21853238 1.00 ELANE (0.42) ELANEHRH3HTR2CHTR2BSCN4A
SCHEMBL27319483 0.79 HRH3 (0.35) HRH3DPP4PKMCHRNB2CHRNA4
SCHEMBL27705179 0.78 ELANE (0.43) ELANEHTR2CHTR2BCYP1A2PKM
SCHEMBL23356900 0.77 DPP4 (0.49) ELANEHTR2CHTR2BSCN4ACYP1A2
SCHEMBL4447785 0.77 DPP4 (0.49) ELANEHTR2CHTR2BSCN4ACYP1A2
SCHEMBL2016284 0.77 DPP4 (0.49) ELANEHTR2CHTR2BSCN4ACYP1A2
SCHEMBL4881023 0.77 CHRNB4 (0.39) ELANEHTR2CHTR2BSCN4ACYP1A2
SCHEMBL28888004 0.77 SCN4A (0.39) ELANEHTR2CHTR2BSCN4ACYP1A2
SCHEMBL28803733 0.77 ELANE (0.48) ELANESCN4ACYP1A2CYP3A4CYP2D6
SCHEMBL20558297 0.77 KMT2A (0.46) ELANECYP1A2PKMFURIN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240294520-A1 AMINO ACID COMPOUNDS WITH UNBRANCHED LINKERS AND METHODS OF USE PLIANT THERAPEUTICS INC (US) 2024-09-05 — — US disclosed
CN-112689507-B Amino acid compounds having unbranched linkers and methods of use thereof 普利安特治疗公司 2024-07-30 — — CN disclosed
US-11858931-B2 Amino acid compounds with unbranched linkers and methods of use PLIANT THERAPEUTICS, INC. (US) 2024-01-02 — — US disclosed
US-20220289743-A1 AMINO ACID COMPOUNDS WITH UNBRANCHED LINKERS AND METHODS OF USE PLIANT THERAPEUTICS, INC. 2022-09-15 — — US disclosed
US-11396506-B2 Amino acid compounds with unbranched linkers and methods of use PLIANT THERAPEUTICS, INC. (US) 2022-07-26 — — US disclosed
EP-3813818-A1 AMINO ACID COMPOUNDS WITH UNBRANCHED LINKERS AND METHODS OF USE Pliant Therapeutics, Inc. (US) 2021-05-05 — — EP disclosed
CN-112689507-A Amino acid compounds having unbranched linkers and methods of use thereof 普利安特治疗公司 2021-04-20 — — CN disclosed
US-20200123151-A1 AMINO ACID COMPOUNDS WITH UNBRANCHED LINKERS AND METHODS OF USE PLIANT THERAPEUTICS, INC. 2020-04-23 — — 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-11396506-B2 Amino acid compounds with unbranched linkers and methods of use ITGA2B, ITGB6, ITGB1 ELANE 572/4885HRH3 284/4885HTR2C 4600/4885
US-20200123151-A1 AMINO ACID COMPOUNDS WITH UNBRANCHED LINKERS AND METHODS OF USE ITGA2B, ITGB6, ITGB1 ELANE 572/4885HRH3 284/4885HTR2C 4600/4885
US-20240294520-A1 AMINO ACID COMPOUNDS WITH UNBRANCHED LINKERS AND METHODS OF USE ITGA2B, ITGB6, ITGB1 ELANE 572/4885HRH3 284/4885HTR2C 4600/4885
US-11858931-B2 Amino acid compounds with unbranched linkers and methods of use ITGA2B, ITGB6, ITGB1 ELANE 572/4885HRH3 284/4885HTR2C 4600/4885
US-20220289743-A1 AMINO ACID COMPOUNDS WITH UNBRANCHED LINKERS AND METHODS OF USE ITGA2B, ITGB6, ITGB1 ELANE 572/4885HRH3 284/4885HTR2C 4600/4885

“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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