SCHEMBL18580919

SCHEMBL18580919

C[C@@H](N)COCc1ccc(Cl)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 1/20 0.57
SLC6A3 Q01959 1/20 0.57
IDO1 P14902 3/20 0.50
HTT P42858 2/20 0.50
AGXT P21549 2/20 0.50
HPGD P15428 1/20 0.50
KMT2A Q03164 1/20 0.49
USP2 O75604 1/20 0.49
GAA P10253 1/20 0.49
MAPK1 P28482 1/20 0.49
RAB9A P51151 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
SLC6A4 P31645 1/20 0.45
TACR1 P25103 2/20 0.44
ADRB2 P07550 1/20 0.42
MAOB P27338 2/20 0.42
CYP3A4 P08684 2/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2D6 P10635 1/20 0.41

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
SCHEMBL8607141 1.00 SLC6A2 (0.57) SLC6A2SLC6A3IDO1HTTAGXT
Hydrochloric Acid SCHEMBL7116534 0.98 SLC6A2 (0.55) SLC6A2SLC6A3IDO1HTTAGXT
SCHEMBL12153202 0.84 HTT (0.53) SLC6A2SLC6A3IDO1HTTAGXT
SCHEMBL9066177 0.81 HTT (0.51) SLC6A2SLC6A3IDO1HTTAGXT
SCHEMBL9452755 0.81 SLC6A2 (0.53) SLC6A2SLC6A3IDO1HTTAGXT
SCHEMBL9066224 0.81 HTT (0.51) SLC6A2SLC6A3IDO1HTTAGXT
SCHEMBL9066226 0.81 HTT (0.51) SLC6A2SLC6A3IDO1HTTAGXT
SCHEMBL9452770 0.81 SLC6A2 (0.53) SLC6A2SLC6A3IDO1HTTAGXT
SCHEMBL10973793 0.81 HTT (0.57) SLC6A2SLC6A3IDO1HTTAGXT
SCHEMBL506937 0.81 IDO1 (0.50) SLC6A2IDO1AGXTTACR1MAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12195446-B2 Heteroaryl compounds and their use as therapeutic drugs DONG-A SOCIO HOLDINGS CO., LTD. (KR) 2025-01-14 US disclosed
US-20230002353-A1 HETEROARYL COMPOUNDS AND THEIR USE AS THERAPEUTIC DRUGS DONG A SOCIO HOLDINGS CO LTD (KR) 2023-01-05 US disclosed
CN-108368083-B Heteroaryl compounds and their use as therapeutic agents 东亚首希控股股份有限公司 2022-02-01 CN disclosed
US-10947215-B2 Heteroaryl compounds and their use as therapeutic drugs DONG-A SOCIO HOLDINGS CO., LTD. (KR) 2021-03-16 US disclosed
EP-3344613-B1 HETEROARYL COMPOUNDS AND THEIR USE AS THERAPEUTIC DRUGS DONG A SOCIO HOLDINGS CO LTD (KR) 2020-03-04 EP disclosed
US-20190119252-A1 HETEROARYL COMPOUNDS AND THEIR USE AS THERAPEUTIC DRUGS DONG-A SOCIO HOLDINGS CO., LTD. (KR) 2019-04-25 US disclosed
US-10125118-B2 Heteroaryl compounds and their use as therapeutic drugs DONG-A SOCIO HOLDINGS CO., LTD. (KR) 2018-11-13 US disclosed
EP-3344613-A1 HETEROARYL COMPOUNDS AND THEIR USE AS THERAPEUTIC DRUGS Dong-A Socio Holdings Co., Ltd. (KR) 2018-07-11 EP disclosed
US-20170355690-A9 HETEROARYL COMPOUNDS AND THEIR USE AS THERAPEUTIC DRUGS DONG-A SOCIO HOLDINGS CO., LTD. (KR) 2017-12-14 US disclosed
US-20170066742-A1 HETEROARYL COMPOUNDS AND THEIR USE AS THERAPEUTIC DRUGS DONG-A SOCIO HOLDINGS CO LTD (KR) 2017-03-09 US disclosed
WO-2017039331-A1 HETEROARYL COMPOUNDS AND THEIR USE AS THERAPEUTIC DRUGS DONG-A SOCIO HOLDINGS CO., LTD. (KR) 2017-03-09 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 (7 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-20170355690-A9 HETEROARYL COMPOUNDS AND THEIR USE AS THERAPEUTIC DRUGS MERTK, ERBB2, SRC SLC6A2 1378/4885SLC6A3 1089/4885IDO1 2290/4885
US-10947215-B2 Heteroaryl compounds and their use as therapeutic drugs MERTK, ERBB2, SRC SLC6A2 1378/4885SLC6A3 1089/4885IDO1 2290/4885
US-12195446-B2 Heteroaryl compounds and their use as therapeutic drugs MERTK, ERBB2, SRC SLC6A2 1378/4885SLC6A3 1089/4885IDO1 2290/4885
US-10125118-B2 Heteroaryl compounds and their use as therapeutic drugs MERTK, ERBB2, SRC SLC6A2 1378/4885SLC6A3 1089/4885IDO1 2290/4885
US-20190119252-A1 HETEROARYL COMPOUNDS AND THEIR USE AS THERAPEUTIC DRUGS MERTK, ERBB2, SRC SLC6A2 1378/4885SLC6A3 1089/4885IDO1 2290/4885
US-20230002353-A1 HETEROARYL COMPOUNDS AND THEIR USE AS THERAPEUTIC DRUGS MERTK, ERBB2, SRC SLC6A2 1378/4885SLC6A3 1089/4885IDO1 2290/4885
US-20170066742-A1 HETEROARYL COMPOUNDS AND THEIR USE AS THERAPEUTIC DRUGS MERTK, ERBB2, SRC SLC6A2 1378/4885SLC6A3 1089/4885IDO1 2290/4885

“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.