SCHEMBL7005505

SCHEMBL7005505

Ic1ccc2[nH]cc(C3=CCN(CCc4ccccc4)CC3)c2n1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 6/20 0.50
DRD2 P14416 5/20 0.50
SIGMAR1 Q99720 2/20 0.50
HTR2A P28223 2/20 0.50
TMEM97 Q5BJF2 1/20 0.50
HTT P42858 1/20 0.50
OPRM1 P35372 1/20 0.48
OPRK1 P41145 1/20 0.48
HTR1F P30939 2/20 0.47
DRD4 P21917 1/20 0.45
DRD3 P35462 1/20 0.45
KDM4E B2RXH2 1/20 0.44
LMNA P02545 1/20 0.44
ALOX15 P16050 1/20 0.44
PARP1 P09874 1/20 0.42

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
SCHEMBL7012307 0.88 HTR1A (0.50) HTR1ADRD2SIGMAR1HTR2ATMEM97
SCHEMBL7095378 0.85 HTR1F (0.54) HTR1ADRD2SIGMAR1HTR2ATMEM97
SCHEMBL7008625 0.81 HTR1F (0.75) HTR1ADRD2SIGMAR1HTR2ATMEM97
SCHEMBL7004667 0.80 HTR1F (0.66) HTR1ADRD2SIGMAR1HTR2ATMEM97
SCHEMBL7011170 0.80 HTR1F (0.65) HTR1ADRD2SIGMAR1HTR2ATMEM97
SCHEMBL7010825 0.80 HTR1F (0.60) HTR1ADRD2SIGMAR1HTR2ATMEM97
Hydrochloric Acid SCHEMBL11318644 0.79 HTR1A (0.78) HTR1ADRD2SIGMAR1HTR2ATMEM97
SCHEMBL11329993 0.79 HTR1A (0.78) HTR1ADRD2SIGMAR1HTR2ATMEM97
SCHEMBL7009808 0.78 HTR1F (0.62) HTR1ADRD2SIGMAR1HTR2ATMEM97
SCHEMBL7011190 0.78 HTR1F (0.57) HTR1ADRD2SIGMAR1HTR2ATMEM97

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-20260125645-A1 METHODS AND PHARMACOLOGICAL AGENTS FOR INCREASING EXPANSION, ENGRAFTMENT OR IMMUNE OUTPUT OF HUMAN HEMATOPOIETIC STEM CELLS IN TRANSPLANTATION AND DISEASE SETTINGS VALORISATION HSJ LP (CA) 2026-05-07 US disclosed
WO-2024073845-A1 METHODS AND PHARMACOLOGICAL AGENTS FOR INCREASING EXPANSION, ENGRAFTMENT OR IMMUNE OUTPUT OF HUMAN HEMATOPOIETIC STEM CELLS IN TRANSPLANTATION AND DISEASE SETTINGS VALORISATION HSJ, LIMITED PARTNERSHIP (CA) 2024-04-11 WO disclosed
EP-0916670-B1 Pyrrolo-(3,2-b) pyridines and their use as 5-HT1F agonists LILLY CO ELI (US) 2003-05-14 EP disclosed
EP-0916670-A2 Pyrrolo-(3,2-b) pyridines and their use as 5-HT1F agonists ELI LILLY AND COMPANY (US) 1999-05-19 EP disclosed
US-5905084-A 5-SUBSTITUTED-3-(PIPERIDIN-4-YL)- AND -3-(1,2,3,6-TETRAHYDROPYRIDIN-4-YL)PYRROLO(3,2-B)PYRIDINES; SIDE EFFECT REDUCTION; NERVOUS SYTEM AND PSYCHOLOGICAL DISORDERS ELI LILLY AND COMPANY (US) 1999-05-18 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 (1 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-20260125645-A1 METHODS AND PHARMACOLOGICAL AGENTS FOR INCREASING EXPANSION, ENGRAFTMENT OR IMMUNE OUTPUT OF HUMAN HEMATOPOIETIC STEM CELLS IN TRANSPLANTATION AND DISEASE SETTINGS HTR1F, HTR1A, HTR1D HTR1A 2/4885DRD2 691/4885SIGMAR1 1249/4885

“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.