SCHEMBL21872978

SCHEMBL21872978

COc1cnc2[nH]cc(Cc3ccc(-c4cnc(N(C)CCCO)nc4OC)nc3C)c2c1

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 14/20 0.42
▸ CYP2C9 P11712 7/20 0.42
▸ CYP1A2 P05177 1/20 0.40
▸ MTNR1A P48039 1/20 0.40
▸ MTNR1B P49286 1/20 0.40
▸ KIT P10721 2/20 0.36
▸ KDR P35968 2/20 0.36
▸ FLT3 P36888 2/20 0.36
▸ AURKC Q9UQB9 2/20 0.36
▸ CSF1R P07333 2/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ AURKA O14965 1/20 0.32

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
SCHEMBL21873144 0.94 KIT (0.43) CYP3A4CYP2C9KITKDRFLT3
SCHEMBL21873019 0.92 CYP3A4 (0.43) CYP3A4CYP2C9CYP1A2KITKDR
SCHEMBL21873005 0.92 CYP2C9 (0.39) CYP3A4CYP2C9CYP1A2KITKDR
SCHEMBL21873151 0.89 AURKA (0.43) CYP3A4CYP2C9MTNR1AKITKDR
SCHEMBL21873004 0.87 PDPK1 (0.41) KDR
SCHEMBL21872977 0.83 CYP2C9 (0.38) CYP3A4CYP2C9CYP1A2MTNR1AMTNR1B
SCHEMBL21872994 0.80 CYP2C9 (0.36) CYP3A4CYP2C9CYP1A2KITKDR
SCHEMBL21873103 0.79 CYP3A4 (0.41) CYP3A4CYP2C9MTNR1AKITKDR
SCHEMBL21873027 0.78 CYP3A4 (0.38) CYP3A4CYP2C9KITKDRFLT3
SCHEMBL21872993 0.78 CYP2C9 (0.38) CYP3A4CYP2C9CYP1A2KITKDR

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 8 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
CN-110461841-B Nitrogen heteroaryl derivative with CSF1R inhibitory activity, and preparation method and application thereof 上海和誉生物医药科技有限公司 2020-09-15 — — CN 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
CN-110461841-A A kind of azepine aryl derivatives, preparation method and application with CSF1R inhibitory activity ABBISKO THERAPEUTICS CO LTD 2019-11-15 — — CN 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 3017/4885CYP1A2 3776/4885
US-11180495-B2 Nitrogen heteroaryl derivative having CSF1R inhibitory activity, and preparation method therefor and application thereof CSF1R, CSF3R, FSHR CYP3A4 2278/4885CYP2C9 3017/4885CYP1A2 3776/4885

“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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