SCHEMBL18313742

SCHEMBL18313742

Fc1ccc(COc2cc(CNCC3CCCCC3)cc(OCc3ccc(F)cc3F)c2)c(F)c1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ HTR2C P28335 10/20 0.47
▸ HTR2A P28223 9/20 0.47
▸ SLC6A4 P31645 9/20 0.47
▸ HDAC6 Q9UBN7 2/20 0.43
▸ HDAC3 O15379 1/20 0.43
▸ HDAC1 Q13547 1/20 0.43
▸ HDAC2 Q92769 1/20 0.43
▸ HDAC8 Q9BY41 1/20 0.43
▸ MAOB P27338 1/20 0.43
▸ GSK3B P49841 1/20 0.42
▸ BACE1 P56817 1/20 0.42
▸ PPARA Q07869 1/20 0.41
▸ RAB9A P51151 3/20 0.39
▸ NPC1 O15118 2/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ PREP P48147 1/20 0.38
▸ POLB P06746 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL18313620 0.84 HTR2C (0.46) HTR2CHTR2ASLC6A4HDAC6HDAC3
SCHEMBL18313743 0.83 ALDH1A1 (0.50) HTR2CHTR2ASLC6A4MAOBBACE1
SCHEMBL3956974 0.81 HDAC6 (0.58) HTR2CHTR2ASLC6A4HDAC6HDAC3
SCHEMBL17481533 0.79 KMT2A (0.48) MAOBGSK3BBACE1PPARARAB9A
SCHEMBL20314097 0.76 SMN1; SMN2 (0.44) HTR2CHTR2ASLC6A4MAOBGSK3B
SCHEMBL22877395 0.76 HTT (0.43) HTR2CHTR2ASLC6A4MAOBGSK3B
SCHEMBL17481418 0.76 IDO1 (0.44) MAOBGSK3BBACE1PPARASMN1; SMN2
SCHEMBL8041968 0.72 SMN1; SMN2 (0.65) HDAC6HDAC3HDAC1HDAC8RAB9A
SCHEMBL18306072 0.70 KMT2A (0.47) HTR2CHTR2ASLC6A4HDAC6PPARA
SCHEMBL13602920 0.69 MAPK14 (0.45) PREP

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-11560352-B2 P62-ZZ small molecule modulators University of Pittsburgh—of the Commonwealth System of Higher Education (US) 2023-01-24 — — US disclosed
US-11560352-B2 P62-ZZ small molecule modulators University of Pittsburgh—of the Commonwealth System of Higher Education (US) 2023-01-24 — — US disclosed
US-20210009506-A1 P62-ZZ SMALL MOLECULE MODULATORS UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2021-01-14 — — US disclosed
US-20210009506-A1 P62-ZZ SMALL MOLECULE MODULATORS UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2021-01-14 — — US disclosed
US-10759739-B2 P62-ZZ small molecule modulators University of Pittsburgh—of the Commonwealth System of Higher Education (US) 2020-09-01 — — US disclosed
US-10759739-B2 P62-ZZ small molecule modulators University of Pittsburgh—of the Commonwealth System of Higher Education (US) 2020-09-01 — — US disclosed
US-20180265452-A1 P62-ZZ CHEMICAL INHIBITOR UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2018-09-20 — — US disclosed
WO-2016200827-A1 P62-ZZ CHEMICAL INHIBITOR UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2016-12-15 — — 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 (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-20210009506-A1 P62-ZZ SMALL MOLECULE MODULATORS ADRM1, SQSTM1, NCOR1 HTR2C 1076/4885HTR2A 894/4885SLC6A4 1327/4885
US-10759739-B2 P62-ZZ small molecule modulators ADRM1, SQSTM1, NCOR1 HTR2C 1074/4885HTR2A 886/4885SLC6A4 1304/4885
US-11560352-B2 P62-ZZ small molecule modulators ADRM1, SQSTM1, NCOR1 HTR2C 1076/4885HTR2A 894/4885SLC6A4 1327/4885
US-20180265452-A1 P62-ZZ CHEMICAL INHIBITOR SQSTM1, ADRM1, NCOR1 HTR2C 1074/4885HTR2A 1167/4885SLC6A4 1471/4885

“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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