SCHEMBL6601965

SCHEMBL6601965

OC1CCN(CCCc2c[nH]c3c2CCCC3)CC1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SPHK1 Q9NYA1 1/20 0.40
HRH3 Q9Y5N1 2/20 0.39
ACHE P22303 1/20 0.39
HTR1A P08908 3/20 0.39
LCK P06239 2/20 0.39
FYN P06241 2/20 0.39
YES1 P07947 2/20 0.39
PDGFRB P09619 2/20 0.39
FGFR1 P11362 2/20 0.39
SRC P12931 2/20 0.39
KDR P35968 2/20 0.39
MPO P05164 1/20 0.37
DRD2 P14416 3/20 0.36
HTR1D P28221 1/20 0.35
HTR1B P28222 1/20 0.35
KCNA3 P22001 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
SCHEMBL5414463 0.87 MPO (0.47) HRH3HTR1AMPODRD2HTR1D
SCHEMBL5396500 0.83 MAPT (0.49) HTR1ALCKFYNYES1PDGFRB
SCHEMBL6613728 0.83 SIGMAR1 (0.44) HTR1ASRCMPODRD2HTR1D
SCHEMBL7959526 0.77 MPO (0.55) HTR1AMPODRD2HTR1DHTR1B
SCHEMBL7961169 0.75 MAPT (0.45) HTR1AMPODRD2HTR1DHTR1B
SCHEMBL7960011 0.75 SIGMAR1 (0.52) HTR1ADRD2HTR1DHTR1B
SCHEMBL7961060 0.75 HTR1A (0.54) HTR1AMPODRD2HTR1DHTR1B
SCHEMBL6612944 0.71 SRC (0.54) SPHK1LCKFYNYES1PDGFRB
SCHEMBL6405708 0.68 MPO (0.43) HTR1AMPODRD2HTR1DHTR1B
SCHEMBL6681210 0.68 MPO (0.41) HTR1AMPOHTR1DHTR1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040266855-A1 3-(4,5,6,7-tetrahydroindol-2-ylmethylidiene)-2-indolinone derivatives as kinase inhibitors SUGEN, INC. 2004-12-30 US disclosed
US-6777417-B2 ANTICANCER AGENTS SUGEN, INC. 2004-08-17 US disclosed
EP-1436259-A1 3-(4,5,6,7-TETRAHYDROINDOL-2-YLMETHYLIDIENE)-2-INDOLINONE DERIVATIVES AS KINASE INHIBITORS Liang, Congxin (US) 2004-07-14 EP disclosed
US-20030119819-A1 3-(4,5,6,7-Tetrahydroindol-2-ylmethylidiene-2-indolinone derivatives as kinase inhibitors SUGEN, INC. 2003-06-26 US disclosed
WO-2003022815-A1 3-(4,5,6,7-TETRAHYDROINDOL-2-YLMETHYLIDIENE)-2-INDOLINONE DERIVATIVES AS KINASE INHIBITORS SUGEN, INC. (US) 2003-03-20 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 (2 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-20040266855-A1 3-(4,5,6,7-tetrahydroindol-2-ylmethylidiene)-2-indolinone derivatives as kinase inhibitors SRC, LCK, MAP3K20 SPHK1 395/4885HRH3 1831/4885ACHE 1876/4885
US-20030119819-A1 3-(4,5,6,7-Tetrahydroindol-2-ylmethylidiene-2-indolinone derivatives as kinase inhibitors SRC, LCK, MAP3K20 SPHK1 380/4885HRH3 1531/4885ACHE 1881/4885

“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.