SCHEMBL20627642

SCHEMBL20627642

Cc1nc2ccccc2n1-c1ccc(NC=O)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 1/20 0.62
▸ HTT P42858 1/20 0.62
▸ NPC1 O15118 1/20 0.49
▸ TSHR P16473 1/20 0.48
▸ KDM4E B2RXH2 1/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ HSD17B10 Q99714 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.43
▸ BMI1 P35226 1/20 0.43
▸ HRH3 Q9Y5N1 4/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ TUBB4A P04350 2/20 0.43
▸ TUBB P07437 2/20 0.43
▸ TUBA3C P0DPH7 2/20 0.43
▸ TUBA1B P68363 2/20 0.43
▸ TUBA4A P68366 2/20 0.43
▸ TUBB4B P68371 2/20 0.43
▸ TUBB3 Q13509 2/20 0.43
▸ TUBB2A Q13885 2/20 0.43
▸ TUBB8 Q3ZCM7 2/20 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
SCHEMBL20627758 0.83 SMN1; SMN2 (0.42) MAPK1HTTTSHRSMN1; SMN2ALDH1A1
SCHEMBL14222780 0.81 MAPK1 (0.68) MAPK1HTTTSHRKDM4ESMN1; SMN2
SCHEMBL7760076 0.78 MAPK1 (0.79) MAPK1HTTNPC1TSHRKDM4E
SCHEMBL540947 0.78 MAPK1 (1.00) MAPK1HTTNPC1TSHRKDM4E
SCHEMBL14004824 0.75 MAPK1 (0.74) MAPK1HTTTSHRKDM4ESMN1; SMN2
SCHEMBL338236 0.75 MAPK1 (0.74) MAPK1HTTTSHRKDM4ESMN1; SMN2
SCHEMBL22507416 0.75 MAPK1 (0.74) MAPK1HTTTSHRKDM4ESMN1; SMN2
SCHEMBL19844108 0.75 MAPK1 (0.80) MAPK1HTTNPC1TSHRKDM4E
SCHEMBL13495663 0.75 MAPK1 (0.74) MAPK1HTTNPC1TSHRKDM4E
SCHEMBL9263231 0.75 MAPK1 (0.74) MAPK1HTTTSHRKDM4ESMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3424924-A1 UREA COMPOUND, PREPARATION METHOD THEREFOR AND MEDICAL USE THEREOF Ancureall Pharmaceutical (Shanghai) Co., Ltd. (CN) 2019-01-09 — — EP disclosed
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