SCHEMBL22265652

SCHEMBL22265652

Fc1cc(CC2CCNCC2)cc(F)c1F

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 1/20 0.53
SLC6A4 P31645 5/20 0.43
HRH3 Q9Y5N1 2/20 0.40
HRH4 Q9H3N8 1/20 0.40
CHRM2 P08172 2/20 0.39
CHRM1 P11229 2/20 0.39
CHRM3 P20309 2/20 0.39
CACNA1H O95180 2/20 0.38
DPP4 P27487 1/20 0.36
CACNA1G O43497 1/20 0.35
PRMT5 O14744 1/20 0.34
WDR77 Q9BQA1 1/20 0.34

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
Hydrochloric Acid SCHEMBL18280157 0.98 GBA1 (0.52) GBA1SLC6A4HRH3HRH4CHRM2
SCHEMBL22265346 0.88 GBA1 (0.46) GBA1SLC6A4HRH3HRH4CHRM1
SCHEMBL20169303 0.86 CYP2C9 (0.36) GBA1
SCHEMBL16138420 0.82 GBA1 (0.55) GBA1SLC6A4HRH3HRH4CACNA1H
SCHEMBL717183 0.81 GBA1 (0.55) GBA1SLC6A4DPP4PRMT5WDR77
Hydrochloric Acid SCHEMBL16112905 0.81 GBA1 (0.53) GBA1SLC6A4HRH3HRH4CACNA1H
SCHEMBL15422804 0.81 ESR1 (0.35) GBA1
Hydrochloric Acid SCHEMBL7405591 0.80 GBA1 (0.53) GBA1SLC6A4DPP4PRMT5WDR77
SCHEMBL21005950 0.80 CHRNB2 (0.36) GBA1SLC6A4CACNA1HCACNA1G
SCHEMBL5215583 0.78 GBA1 (0.50) GBA1SLC6A4CACNA1HPRMT5WDR77

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12268687-B2 Compounds and uses thereof JANSSEN PHARMACEUTICA NV (BE) 2025-04-08 US disclosed
US-20250034125-A1 COMPOUNDS AND USES THEREOF JANSSEN PHARMACEUTICA NV (BE) 2025-01-30 US disclosed
US-20250034124-A1 COMPOUNDS AND USES THEREOF JANSSEN PHARMACEUTICA NV (BE) 2025-01-30 US disclosed
US-12098146-B2 Compounds and uses thereof JANSSEN PHARMACEUTICA NV (BE) 2024-09-24 US disclosed
US-20230116101-A1 COMPOUNDS AND USES THEREOF YUMANITY THERAPEUTICS, INC. 2023-04-13 US disclosed
CN-113906019-A Compound and use thereof 优曼尼蒂治疗公司 2022-01-07 CN disclosed
EP-3914593-A1 COMPOUNDS AND USES THEREOF Yumanity Therapeutics, Inc. (US) 2021-12-01 EP disclosed
WO-2021097240-A1 COMPOUNDS AND USES THEREOF YUMANITY THERAPEUTICS, INC. (US) 2021-05-20 WO disclosed
WO-2021097240-A1 COMPOUNDS AND USES THEREOF YUMANITY THERAPEUTICS, INC. (US) 2021-05-20 WO disclosed
US-20210139471-A1 COMPOUNDS AND USES THEREOF JANSSEN PHARMACEUTICA NV (BE) 2021-05-13 US disclosed
US-20210139471-A1 COMPOUNDS AND USES THEREOF JANSSEN PHARMACEUTICA NV (BE) 2021-05-13 US disclosed
WO-2020154571-A1 COMPOUNDS AND USES THEREOF YUMANITY THERAPEUTICS, INC. (US) 2020-07-30 WO disclosed
WO-2020154571-A1 COMPOUNDS AND USES THEREOF YUMANITY THERAPEUTICS, INC. (US) 2020-07-30 WO disclosed
CN-104725356-B Nitrogen heterocyclic derivatives and application thereof in medicine 广东东阳光药业有限公司 2017-02-22 CN disclosed
CN-104725356-A Nitrogen heterocyclic derivatives and application thereof in medicine GUANGDONG HEC PHARMACEUTICAL 2015-06-24 CN 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 (6 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-20250034124-A1 COMPOUNDS AND USES THEREOF NLN, BDNF, NQO1 GBA1 173/4885SLC6A4 451/4885HRH3 3261/4885
US-12268687-B2 Compounds and uses thereof NLN, BDNF, NQO1 GBA1 173/4885SLC6A4 451/4885HRH3 3261/4885
US-20230116101-A1 COMPOUNDS AND USES THEREOF NLN, BDNF, NQO1 GBA1 173/4885SLC6A4 451/4885HRH3 3261/4885
US-20250034125-A1 COMPOUNDS AND USES THEREOF NLN, BDNF, NQO1 GBA1 173/4885SLC6A4 451/4885HRH3 3261/4885
US-20210139471-A1 COMPOUNDS AND USES THEREOF NLN, BDNF, NQO1 GBA1 173/4885SLC6A4 451/4885HRH3 3261/4885
US-12098146-B2 Compounds and uses thereof NLN, BDNF, NQO1 GBA1 173/4885SLC6A4 451/4885HRH3 3261/4885

“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.