SCHEMBL8420394

SCHEMBL8420394

Cc1nc(CN2CCC(C(=O)N3CCN(Cc4ccccc4Br)CC3)CC2)cs1

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.55
▸ ALDH1A1 P00352 4/20 0.48
▸ SMN1; SMN2 Q16637 1/20 0.48
▸ HPGD P15428 1/20 0.47
▸ TSHR P16473 1/20 0.47
▸ KDM4E B2RXH2 4/20 0.47
▸ LMNA P02545 1/20 0.47
▸ FAAH O00519 1/20 0.44
▸ PHGDH O43175 1/20 0.44
▸ DHODH Q02127 4/20 0.44
▸ RORC P51449 3/20 0.44
▸ MEN1 O00255 1/20 0.43
▸ ACKR3 P25106 1/20 0.43

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
SCHEMBL8223179 0.79 TSHR (0.49) KMT2AALDH1A1SMN1; SMN2HPGDTSHR
SCHEMBL8223139 0.78 TSHR (0.48) KMT2AALDH1A1SMN1; SMN2HPGDTSHR
SCHEMBL14456706 0.78 TSHR (0.48) KMT2AALDH1A1SMN1; SMN2HPGDTSHR
SCHEMBL14456744 0.77 KMT2A (0.56) KMT2AALDH1A1SMN1; SMN2TSHRKDM4E
SCHEMBL14456685 0.75 ALDH1A1 (0.57) KMT2AALDH1A1SMN1; SMN2HPGDTSHR
SCHEMBL14469623 0.75 TSHR (0.48) KMT2AALDH1A1SMN1; SMN2HPGDTSHR
SCHEMBL8230258 0.75 TSHR (0.49) KMT2AALDH1A1SMN1; SMN2HPGDTSHR
SCHEMBL14456705 0.75 KDM4E (0.53) KMT2AALDH1A1HPGDTSHRKDM4E
SCHEMBL6994266 0.75 KMT2A (0.53) KMT2AALDH1A1SMN1; SMN2HPGDKDM4E
SCHEMBL8420393 0.74 ALDH1A1 (0.44) KMT2AALDH1A1SMN1; SMN2HPGDTSHR

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-7238688-B2 Piperidine compounds SCHERING CORPORATION (US) 2007-07-03 — — US disclosed
US-7238688-B2 Piperidine compounds SCHERING CORPORATION (US) 2007-07-03 — — US disclosed
US-20070142369-A1 Combination of an H3 antagonist/inverse agonist and an appetite suppressant SCHERING CORPORATION 2007-06-21 — — 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-20070142369-A1 Combination of an H3 antagonist/inverse agonist and an appetite suppressant CNR2, GPR119, GLP1R KMT2A 193/4885ALDH1A1 3184/4885SMN1; SMN2 4298/4885

“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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