SCHEMBL21873014

SCHEMBL21873014

COc1nc(N(C)CCCO[Si](C)(C)C(C)(C)C)ncc1-c1ccc(Cc2c[nH]c3ncccc23)c(C)n1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AURKA O14965 2/20 0.40
▸ CYP3A4 P08684 6/20 0.38
▸ CYP2C19 P33261 2/20 0.38
▸ GPR84 Q9NQS5 1/20 0.36
▸ FGFR1 P11362 1/20 0.35
▸ FGFR4 P22455 1/20 0.35
▸ CDC7 O00311 4/20 0.34
▸ CYP2C9 P11712 4/20 0.34
▸ DYRK1A Q13627 2/20 0.33
▸ MET P08581 2/20 0.32
▸ DBF4 Q9UBU7 1/20 0.31
▸ CSF1R P07333 1/20 0.30
▸ KIT P10721 1/20 0.30
▸ KDR P35968 1/20 0.30
▸ FLT3 P36888 1/20 0.30
▸ AURKC Q9UQB9 1/20 0.30
▸ MAP4K4 O95819 2/20 0.30
▸ PIM1 P11309 2/20 0.30
▸ PRKACA P17612 2/20 0.30
▸ GSK3B P49841 2/20 0.30

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
SCHEMBL21872994 0.89 CYP2C9 (0.36) CYP3A4CYP2C19CYP2C9CSF1RKIT
SCHEMBL21873151 0.87 AURKA (0.43) AURKACYP3A4CYP2C19GPR84FGFR1
SCHEMBL21873033 0.83 CYP3A4 (0.36) AURKACYP3A4CYP2C19GPR84FGFR1
SCHEMBL21873027 0.81 CYP3A4 (0.38) CYP3A4CYP2C19CYP2C9CSF1RKIT
SCHEMBL21873058 0.80 CYP3A4 (0.38) AURKACYP3A4CYP2C19CYP2C9CSF1R
SCHEMBL21873103 0.78 CYP3A4 (0.41) AURKACYP3A4CYP2C19GPR84FGFR1
SCHEMBL21872978 0.76 CYP3A4 (0.42) AURKACYP3A4CYP2C19CYP2C9CSF1R
SCHEMBL21873144 0.76 KIT (0.43) CYP3A4CYP2C19CYP2C9CSF1RKIT
SCHEMBL21873019 0.75 CYP3A4 (0.43) CYP3A4CYP2C19CYP2C9CSF1RKIT
SCHEMBL21873005 0.75 CYP2C9 (0.39) CYP3A4CYP2C19CYP2C9CSF1RKIT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11180495-B2 Nitrogen heteroaryl derivative having CSF1R inhibitory activity, and preparation method therefor and application thereof ABBISKO THERAPEUTICS CO., LTD. (CN) 2021-11-23 — — US disclosed
US-11180495-B2 Nitrogen heteroaryl derivative having CSF1R inhibitory activity, and preparation method therefor and application thereof ABBISKO THERAPEUTICS CO., LTD. (CN) 2021-11-23 — — US disclosed
US-20200140431-A1 NITROGEN HETEROARYL DERIVATIVE HAVING CSF1R INHIBITORY ACTIVITY, AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF ABBISKO THERAPEUTICS CO., LTD. (CN) 2020-05-07 — — US disclosed
US-20200140431-A1 NITROGEN HETEROARYL DERIVATIVE HAVING CSF1R INHIBITORY ACTIVITY, AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF ABBISKO THERAPEUTICS CO., LTD. (CN) 2020-05-07 — — US disclosed
EP-3643715-A1 NITROGEN HETEROARYL DERIVATIVE HAVING CSF1R INHIBITORY ACTIVITY, AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF Abbisko Therapeutics Co., Ltd. (CN) 2020-04-29 — — EP disclosed
EP-3643715-A1 NITROGEN HETEROARYL DERIVATIVE HAVING CSF1R INHIBITORY ACTIVITY, AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF Abbisko Therapeutics Co., Ltd. (CN) 2020-04-29 — — EP 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-20200140431-A1 NITROGEN HETEROARYL DERIVATIVE HAVING CSF1R INHIBITORY ACTIVITY, AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF CSF1R, CSF3R, FSHR AURKA 3341/4885CYP3A4 2278/4885CYP2C19 1843/4885
US-11180495-B2 Nitrogen heteroaryl derivative having CSF1R inhibitory activity, and preparation method therefor and application thereof CSF1R, CSF3R, FSHR AURKA 3341/4885CYP3A4 2278/4885CYP2C19 1843/4885

“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.

Send feedback