SCHEMBL16853886

SCHEMBL16853886

CCOC(=O)Cc1ccc(OC2CC2)cn1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MBOAT4 Q96T53 1/20 0.46
PRMT5 O14744 2/20 0.41
ACACB O00763 5/20 0.41
ACACA Q13085 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
TP53 P04637 1/20 0.39
MAOA P21397 1/20 0.39
MAOB P27338 1/20 0.39
POLB P06746 1/20 0.39
KCNH2 Q12809 1/20 0.38
MCHR1 Q99705 1/20 0.38
GPR119 Q8TDV5 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38

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
SCHEMBL16828605 0.82 MBOAT4 (0.44) MBOAT4ACACBACACAKCNH2MCHR1
SCHEMBL20339333 0.82 TP53 (0.50) SMN1; SMN2TP53MAOBPOLBMEN1
SCHEMBL17317996 0.82 MBOAT4 (0.43) MBOAT4SMN1; SMN2MEN1KMT2A
SCHEMBL3334225 0.80 MAPK1 (0.47) SMN1; SMN2MEN1KMT2A
SCHEMBL2635600 0.78 SMN1; SMN2 (0.51) SMN1; SMN2MAOAMEN1KMT2A
SCHEMBL14677406 0.77 SMN1; SMN2 (0.46) PRMT5SMN1; SMN2MEN1KMT2A
SCHEMBL1135124 0.77 SMN1; SMN2 (0.46) SMN1; SMN2POLBMEN1KMT2A
SCHEMBL21323610 0.76 SMN1; SMN2 (0.45) SMN1; SMN2TP53MEN1KMT2A
SCHEMBL30697582 0.76 PRMT5 (0.60) PRMT5MAOBMEN1KMT2A
SCHEMBL104202 0.76 MBOAT4 (0.44) MBOAT4ACACBACACAKCNH2MCHR1

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-20170305857-A1 N-ACYLPIPERIDINE ETHER TROPOMYOSIN-RELATED KINASE INHIBITORS PFIZER LIMITED (UK) 2017-10-26 US disclosed
US-20170305857-A1 N-ACYLPIPERIDINE ETHER TROPOMYOSIN-RELATED KINASE INHIBITORS PFIZER LIMITED (UK) 2017-10-26 US disclosed
WO-2015092610-A1 N-ACYLPIPERIDINE ETHER TROPOMYOSIN-RELATED KINASE INHIBITORS PFIZER LIMITED (GB) 2015-06-25 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 (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-20170305857-A1 N-ACYLPIPERIDINE ETHER TROPOMYOSIN-RELATED KINASE INHIBITORS TNNI3, MUSK, MYLK2 MBOAT4 1709/4885PRMT5 919/4885ACACB 1106/4885

“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.