SCHEMBL1735429

SCHEMBL1735429

FC(F)(F)c1ccc2c(c1)NCC2

nearest known ligand 0.60

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PARP10 Q53GL7 2/20 0.60
PARP1 P09874 1/20 0.60
HTR2A P28223 3/20 0.49
HTR2C P28335 3/20 0.49
HTR2B P41595 3/20 0.49
PARP11 Q9NR21 1/20 0.43
ASIC3 Q9UHC3 1/20 0.43
AR P10275 2/20 0.42
S1PR1 P21453 1/20 0.42
PNMT P11086 3/20 0.40
TDP2 O95551 1/20 0.40
DRD2 P14416 1/20 0.40
DRD4 P21917 1/20 0.40
GFER P55789 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
KDM1A O60341 1/20 0.39
DPP4 P27487 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
SCHEMBL30038782 1.00 PARP10 (0.60) PARP10PARP1HTR2AHTR2CHTR2B
SCHEMBL330393 0.89 PARP1 (0.49) PARP10PARP1HTR2AHTR2CHTR2B
SCHEMBL29504937 0.89 PARP1 (0.49) PARP10PARP1HTR2AHTR2CHTR2B
Hydrochloric Acid SCHEMBL7743305 0.87 PARP1 (0.47) PARP10PARP1HTR2AHTR2CHTR2B
SCHEMBL4991137 0.85 PARP10 (0.56) PARP10PARP1HTR2AHTR2CHTR2B
SCHEMBL84336 0.81 TRPV1 (0.43) PARP10PARP1HTR2AHTR2CHTR2B
SCHEMBL3140738 0.80 ASIC3 (0.47) PARP10PARP1HTR2AHTR2CHTR2B
SCHEMBL5775632 0.78 MEN1 (0.44) PARP10PARP1HTR2AHTR2CHTR2B
SCHEMBL2676020 0.75 KIF11 (0.63) PARP10PARP1PARP11ASIC3S1PR1
SCHEMBL10272904 0.75 SMN1; SMN2 (0.46) PARP10PARP1HTR2AHTR2CHTR2B

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 129 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102089278-A Compounds and compositions useful for the treatment of malaria IRM LLC 2011-06-08 CN claimed
CN-118791417-A Pink back pteridonic acid derivative, preparation method and application thereof 安徽工业大学 2024-10-18 CN disclosed
US-20240199607-A1 BICYCLIC HETEROCYCLE COMPOUNDS AND THEIR USES IN THERAPY ASTEX THERAPEUTICS LIMITED (GB) 2024-06-20 US disclosed
US-20240116910-A1 Heterocycles as WIP1 Inhibitors PMV PHARMACEUTICALS, INC. 2024-04-11 US disclosed
US-11866428-B2 Bicyclic heterocycle compounds and their uses in therapy ASTEX THERAPEUTICS LIMITED (GB) 2024-01-09 US disclosed
CN-110612284-B Substituted indoline derivatives as dengue virus replication inhibitors 杨森制药公司 2023-10-31 CN disclosed
US-20230021448-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY NOVARTIS PHARMA AG (CH) 2023-01-26 US disclosed
EP-3436436-B1 SUBSTITUTED INDOLINE DERIVATIVES AS DENGUE VIRAL REPLICATION INHIBITORS JANSSEN PHARMACEUTICALS INC (US) 2022-05-11 EP disclosed
EP-3436436-B1 SUBSTITUTED INDOLINE DERIVATIVES AS DENGUE VIRAL REPLICATION INHIBITORS JANSSEN PHARMACEUTICALS INC (US) 2022-05-11 EP disclosed
US-11180450-B2 Substituted indoline derivatives as dengue viral replication inhibitors Janssen Pharmaceuticals, Inc. (US) 2021-11-23 US disclosed
WO-1999043650-A2 PROCESS(ES) FOR THE PREPARATION OF 6-TRIFLUOROMETHYL-INDOLINE DERIVATIVES SMITHKLINE BEECHAM PLC (GB) 1999-09-02 WO disclosed
CN-1222152-A Indoline derivatives useful as 5-HT-2C receptor antagonists SMITHKLINE BEECHAM PLC (GB) 1999-07-07 CN disclosed
EP-0912556-A1 INDOLINE DERIVATIVES USEFUL AS 5-HT-2C RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 1999-05-06 EP disclosed
CN-1179156-A Indole derivatives as 5-HT receptor antagonists SMITHKINE BEECHAM PLC (GB) 1998-04-15 CN disclosed
WO-1997048700-A1 INDOLINE DERIVATIVES USEFUL AS 5-HT-2C RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 1997-12-24 WO disclosed
WO-1997045408-A1 HERBICIDAL INDOLINES ZENECA LIMITED (GB) 1997-12-04 WO disclosed
EP-0808312-A1 INDOLE DERIVATIVES AS 5-HT RECEPTOR ANTAGONIST SMITHKLINE BEECHAM PLC (GB) 1997-11-26 EP disclosed
EP-0807104-A2 HETEROCYCLIC COMPOUNDS POSSESSING 5HT 2C? RECEPTOR ANTAGONIST ACTIVITY SMITHKLINE BEECHAM PLC (GB) 1997-11-19 EP disclosed
WO-1996023783-A1 INDOLE DERIVATIVES AS 5-HT RECEPTOR ANTAGONIST SMITHKLINE BEECHAM PLC (GB) 1996-08-08 WO disclosed
WO-1996023769-A2 HETEROCYCLIC COMPOUNDS POSSESSING 5HT2C RECEPTOR ANTAGONIST ACTIVITY SMITHKLINE BEECHAM PLC (GB) 1996-08-08 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 (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-11180450-B2 Substituted indoline derivatives as dengue viral replication inhibitors IDO1, INMT, IRF3 PARP10 576/4885PARP1 278/4885HTR2A 155/4885
US-20230021448-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY STING1, CGAS, IRF3 PARP10 1592/4885PARP1 999/4885HTR2A 1988/4885
US-20240199607-A1 BICYCLIC HETEROCYCLE COMPOUNDS AND THEIR USES IN THERAPY H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, CCNB1, CCNE1 PARP10 1436/4885PARP1 1414/4885HTR2A 3085/4885
US-11866428-B2 Bicyclic heterocycle compounds and their uses in therapy H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, CCNB1, CCNE1 PARP10 1436/4885PARP1 1414/4885HTR2A 3085/4885
US-20240116910-A1 Heterocycles as WIP1 Inhibitors WAPL, WHR1, G3BP1 PARP10 481/4885PARP1 606/4885HTR2A 3711/4885

“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.