SCHEMBL14554255

SCHEMBL14554255

CCc1ccc(N2CCN(C)CC2)c(C)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 3/20 0.47
DRD2 P14416 2/20 0.47
DRD4 P21917 2/20 0.47
HTR2A P28223 2/20 0.47
HTR2C P28335 2/20 0.47
DRD3 P35462 2/20 0.47
MAPT P10636 5/20 0.46
GAA P10253 3/20 0.46
RAD52 P43351 2/20 0.46
GFER P55789 1/20 0.46
ALDH1A1 P00352 6/20 0.44
KDM4E B2RXH2 5/20 0.44
TSHR P16473 1/20 0.44
CASP1 P29466 1/20 0.44
POLB P06746 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
PTK2B Q14289 2/20 0.41
MEN1 O00255 1/20 0.41
THRB P10828 1/20 0.41
NR4A1 P22736 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
SCHEMBL12127788 0.85 EML4 (0.47) GAA
SCHEMBL10264230 0.85 EML4 (0.45) MAPTGAARAD52GFERALDH1A1
SCHEMBL29493256 0.85 MAPT (0.45) HTR1ADRD2MAPTGAARAD52
SCHEMBL14922283 0.85 CHKA (0.51) HTR1ADRD2DRD4HTR2ADRD3
SCHEMBL14228541 0.83 HTR1A (0.51) HTR1ADRD2DRD4HTR2AHTR2C
SCHEMBL19251504 0.83 DRD2 (0.61) HTR1ADRD2DRD4HTR2AHTR2C
SCHEMBL8427926 0.81 ALDH1A1 (0.49) HTR1ADRD2DRD4HTR2AHTR2C
SCHEMBL29310427 0.81 HTR3A (0.58) HTR1ADRD2DRD4HTR2AHTR2C
SCHEMBL24478535 0.79 KDM4E (0.64) HTR1ADRD2DRD4HTR2AHTR2C
SCHEMBL19145146 0.79 HTR1A (0.43) HTR1ADRD2DRD4HTR2AHTR2C

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
WO-2024107393-A1 TRICYCLIC COMPOUNDS SCHRÖDINGER, INC. (US) 2024-05-23 WO disclosed
US-8962637-B2 Bicyclic compounds and their uses as dual c-SRC/JAK inhibitors DEBIOPHARM S.A. (CH) 2015-02-24 US disclosed
US-20130143895-A1 BICYCLIC COMPOUNDS AND THEIR USES AS DUAL C-SRC / JAK INHIBITORS DEBIOPHARM S.A. (CH) 2013-06-06 US disclosed
US-8440679-B2 Bicyclic compounds and their uses as dual c-SRC / JAK inhibitors DEBIOPHARM S.A. (CH) 2013-05-14 US disclosed
US-20130012518-A1 BICYCLIC COMPOUNDS AND THEIR USES AS DUAL C-SRC / JAK INHIBITORS AURIGENE DISCOVERY TECHNOLOGIES LTD. (IN) 2013-01-10 US 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-20130012518-A1 BICYCLIC COMPOUNDS AND THEIR USES AS DUAL C-SRC / JAK INHIBITORS JAK2, SRC, JAK1 HTR1A 4404/4885DRD2 4698/4885DRD4 4743/4885
US-20130143895-A1 BICYCLIC COMPOUNDS AND THEIR USES AS DUAL C-SRC / JAK INHIBITORS JAK2, SRC, JAK1 HTR1A 4404/4885DRD2 4698/4885DRD4 4743/4885

“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.