SCHEMBL21873058

SCHEMBL21873058

COc1nc(N(C)CCCO[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)ncc1-c1ccc(Cc2c[nH]c3ncc(F)cc23)c(C)n1

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 12/20 0.38
▸ CYP2C9 P11712 7/20 0.38
▸ KIT P10721 2/20 0.38
▸ KDR P35968 2/20 0.38
▸ FLT3 P36888 2/20 0.38
▸ AURKC Q9UQB9 2/20 0.38
▸ CSF1R P07333 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ CYP1A2 P05177 1/20 0.31
▸ AURKA O14965 1/20 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
SCHEMBL21873027 0.93 CYP3A4 (0.38) CYP3A4CYP2C9KITKDRFLT3
SCHEMBL21873088 0.88 PDPK1 (0.39) —
SCHEMBL21873021 0.85 CYP2C9 (0.33) CYP3A4CYP2C9KITKDRFLT3
SCHEMBL21873019 0.85 CYP3A4 (0.43) CYP3A4CYP2C9KITKDRFLT3
SCHEMBL21873033 0.83 CYP3A4 (0.36) CYP3A4CYP2C9CYP2C19AURKA
SCHEMBL21872994 0.82 CYP2C9 (0.36) CYP3A4CYP2C9KITKDRFLT3
SCHEMBL21873020 0.81 PDPK1 (0.40) —
SCHEMBL21872974 0.81 CYP2C9 (0.33) CYP3A4CYP2C9KITKDRFLT3
SCHEMBL21873014 0.80 AURKA (0.40) CYP3A4CYP2C9KITKDRFLT3
SCHEMBL21872978 0.77 CYP3A4 (0.42) CYP3A4CYP2C9KITKDRFLT3

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-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
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 CYP3A4 2278/4885CYP2C9 3017/4885KIT 59/4885
US-11180495-B2 Nitrogen heteroaryl derivative having CSF1R inhibitory activity, and preparation method therefor and application thereof CSF1R, CSF3R, FSHR CYP3A4 2278/4885CYP2C9 3017/4885KIT 59/4885

“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