SCHEMBL21772010

SCHEMBL21772010

Cc1nc(N)ccc1Oc1ccnc(N(C)C(=O)O)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GABRP O00591 1/20 0.40
▸ GABRD O14764 1/20 0.40
▸ GABRA1 P14867 1/20 0.40
▸ GABRB1 P18505 1/20 0.40
▸ GABRG2 P18507 1/20 0.40
▸ GABRB3 P28472 1/20 0.40
▸ GABRA5 P31644 1/20 0.40
▸ GABRA3 P34903 1/20 0.40
▸ GABRA2 P47869 1/20 0.40
▸ GABRB2 P47870 1/20 0.40
▸ GABRA4 P48169 1/20 0.40
▸ GABRE P78334 1/20 0.40
▸ GABRA6 Q16445 1/20 0.40
▸ GABRG1 Q8N1C3 1/20 0.40
▸ GABRG3 Q99928 1/20 0.40
▸ GABRQ Q9UN88 1/20 0.40
▸ TGFBR1 P36897 6/20 0.38
▸ CSF1R P07333 11/20 0.35
▸ PDGFRA P16234 10/20 0.35
▸ PDGFRB P09619 6/20 0.34

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
SCHEMBL21408156 0.85 TGFBR1 (0.37) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL21408154 0.83 TGFBR1 (0.37) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL27116699 0.80 TGFBR1 (0.35) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL16038352 0.78 TGFBR1 (0.48) TGFBR1CSF1RPDGFRAPDGFRBMET
SCHEMBL16037107 0.77 TGFBR1 (0.45) TGFBR1CSF1RPDGFRAPDGFRBMET
SCHEMBL21425624 0.75 KDR (0.50) CSF1R
SCHEMBL16059181 0.75 CSF1R (0.55) TGFBR1CSF1RPDGFRAPDGFRBMET
SCHEMBL16028424 0.74 SCN9A (0.43) TGFBR1SCN5ASCN9A
SCHEMBL28012733 0.73 MAPK14 (0.37) METSCN9A
SCHEMBL21772013 0.73 TGFBR1 (0.37) GABRPGABRDGABRA1GABRB1GABRG2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3632907-B1 N-(AZAARYL)CYCLOLACTAM-1-CARBOXAMIDE DERIVATIVE, PREPARATION METHOD THEREFOR, AND USE THEREOF ABBISKO THERAPEUTICS CO LTD (CN) 2024-02-28 — — EP disclosed
US-11149021-B2 N-(azaaryl)cyclolactam-1-carboxamide derivative, preparation method therefor, and use thereof ABBISKO THERAPEUTICS CO., LTD. (CN) 2021-10-19 — — US disclosed
EP-3632907-A1 N-(AZAARYL)CYCLOLACTAM-1-CARBOXAMIDE DERIVATIVE, PREPARATION METHOD THEREFOR, AND USE THEREOF Abbisko Therapeutics Co., Ltd. (CN) 2020-04-08 — — EP disclosed
US-20200071302-A1 N-(AZAARYL)CYCLOLACTAM-1-CARBOXAMIDE DERIVATIVE, PREPARATION METHOD THEREFOR, AND USE THEREOF ABBISKO THERAPEUTICS CO., LTD. (CN) 2020-03-05 — — 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 (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-20200071302-A1 N-(AZAARYL)CYCLOLACTAM-1-CARBOXAMIDE DERIVATIVE, PREPARATION METHOD THEREFOR, AND USE THEREOF CSF1R, CSF3R, FAR1 GABRP 1097/4885GABRD 480/4885GABRA1 268/4885
US-11149021-B2 N-(azaaryl)cyclolactam-1-carboxamide derivative, preparation method therefor, and use thereof CSF1R, CSF3R, FAR1 GABRP 1097/4885GABRD 480/4885GABRA1 268/4885

“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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