SCHEMBL4896210

SCHEMBL4896210

O=C1CCc2ccc(CN3CCN(C(=O)N4CCOCC4)CC3)cc21

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 2/20 0.60
HRH3 Q9Y5N1 5/20 0.44
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
TP53 P04637 1/20 0.43
TSHR P16473 1/20 0.43
MAPK1 P28482 1/20 0.43
HPGD P15428 1/20 0.43
FAAH O00519 2/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
ALDH1A1 P00352 2/20 0.40
CHEK1 O14757 1/20 0.40
KMT2A Q03164 1/20 0.40

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
SCHEMBL4815663 0.89 HRH3 (0.48) AKR1C3HRH3HPGDFAAHCYP2C9
SCHEMBL4814888 0.87 TSHR (0.49) AKR1C3HRH3NPC1RAB9ASMN1; SMN2
SCHEMBL4814820 0.81 FAAH (0.46) HRH3SMN1; SMN2TP53MAPK1FAAH
SCHEMBL4815397 0.78 LMNA (0.49) HRH3ALDH1A1
SCHEMBL4819242 0.78 KDM4E (0.56) HRH3SMN1; SMN2TSHRCYP2C9CYP2C19
SCHEMBL4814489 0.78 HRH3 (0.56) HRH3SMN1; SMN2HPGDALDH1A1
SCHEMBL4816573 0.77 GPR119 (0.55) HRH3SMN1; SMN2CYP2C19KMT2A
SCHEMBL4818998 0.77 SMN1; SMN2 (0.58) HRH3NPC1RAB9ASMN1; SMN2TP53
SCHEMBL4894879 0.77 ALDH1A1 (0.49) HRH3NPC1RAB9ASMN1; SMN2TP53
SCHEMBL4811484 0.76 ALDH1A1 (0.44) HRH3SMN1; SMN2TSHRFAAHALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1740579-B1 TRICYCLIC PYRAZOLE KINASE INHIBITORS ABBVIE INC (US) 2015-08-19 EP disclosed
US-7468371-B2 Tricyclic pyrazole kinase inhibitors ABBOTT LABORATORIES INC. (US) 2008-12-23 US disclosed
US-20060014816-A1 Tricyclic pyrazole kinase inhibitors ABBVIE INC. 2006-01-19 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-20060014816-A1 Tricyclic pyrazole kinase inhibitors PRKDC, PRKACA, PIK3C3 AKR1C3 2812/4885HRH3 2235/4885NPC1 3037/4885

“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.