SCHEMBL18909590

SCHEMBL18909590

NC1CN(CC(=O)OCc2ccccc2)CCC1F

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 4/20 0.48
▸ NPC1 O15118 2/20 0.48
▸ RAB9A P51151 2/20 0.48
▸ CYP2C19 P33261 2/20 0.46
▸ DPP4 P27487 4/20 0.43
▸ DPP7 Q9UHL4 4/20 0.43
▸ KCNH2 Q12809 2/20 0.42
▸ ALDH1A1 P00352 2/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40
▸ CYP2C9 P11712 2/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ CYP2D6 P10635 1/20 0.39
▸ GRIN2B Q13224 1/20 0.39
▸ POLB P06746 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.39

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
SCHEMBL25122374 0.89 ALDH1A1 (0.45) SMN1; SMN2NPC1RAB9ACYP2C19DPP4
SCHEMBL22280532 0.87 LTA4H (0.48) SMN1; SMN2NPC1RAB9ACYP2C19ALDH1A1
SCHEMBL23027037 0.87 LTA4H (0.48) SMN1; SMN2NPC1RAB9ACYP2C19ALDH1A1
SCHEMBL19465293 0.86 SMN1; SMN2 (0.46) SMN1; SMN2NPC1RAB9ACYP2C19ALDH1A1
SCHEMBL16900141 0.84 SMN1; SMN2 (0.50) SMN1; SMN2NPC1RAB9ACYP2C19ALDH1A1
SCHEMBL21100502 0.84 ALDH1A1 (0.43) SMN1; SMN2NPC1RAB9ACYP2C19DPP4
SCHEMBL21100504 0.84 ALDH1A1 (0.43) SMN1; SMN2NPC1RAB9ACYP2C19DPP4
SCHEMBL21100503 0.84 ALDH1A1 (0.43) SMN1; SMN2NPC1RAB9ACYP2C19DPP4
SCHEMBL21165288 0.84 ALDH1A1 (0.43) SMN1; SMN2NPC1RAB9ACYP2C19DPP4
SCHEMBL23733552 0.82 SMN1; SMN2 (0.46) SMN1; SMN2NPC1RAB9ACYP2C19ALDH1A1

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
US-10323037-B2 Aminopyridazinone compounds as protein kinase inhibitors JIANGSU HENGRUI MEDICINE CO., LTD. (CN) 2019-06-18 — — US disclosed
US-9951077-B2 Aminopyridazinone compounds as protein kinase inhibitors JIANGSU HENGRUI MEDICINE CO., LTD. (CN) 2018-04-24 — — US disclosed
US-20170152264-A1 AMINOPYRIDAZINONE COMPOUNDS AS PROTEIN KINASE INHIBITORS Eternity Bioscience Inc. (US) 2017-06-01 — — 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-20170152264-A1 AMINOPYRIDAZINONE COMPOUNDS AS PROTEIN KINASE INHIBITORS SSB, MAPKAPK5, BCL9 SMN1; SMN2 4382/4885NPC1 4775/4885RAB9A 2600/4885
US-10323037-B2 Aminopyridazinone compounds as protein kinase inhibitors SSB, MAPKAPK5, BCL9 SMN1; SMN2 4382/4885NPC1 4775/4885RAB9A 2600/4885

“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.

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