SCHEMBL23854138

SCHEMBL23854138

O=C(O)NCCCn1ccc2cncc(F)c2c1=O

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ HDAC1 Q13547 1/20 0.36
▸ HDAC6 Q9UBN7 1/20 0.36
▸ EGLN1 Q9GZT9 3/20 0.35
▸ MGLL Q99685 2/20 0.34
▸ GRM2 Q14416 3/20 0.34
▸ MAPT P10636 2/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ KDM4E B2RXH2 2/20 0.33
▸ HTT P42858 2/20 0.33
▸ POLB P06746 1/20 0.33
▸ TNF P01375 1/20 0.33

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
SCHEMBL31096165 0.84 STK17B (0.41) MGLL
SCHEMBL24407526 0.84 STK17B (0.41) MGLL
SCHEMBL31096322 0.78 KMT2A (0.42) HDAC6EGLN1GRM2MAPTALDH1A1
SCHEMBL23850234 0.78 KMT2A (0.42) HDAC6EGLN1GRM2MAPTALDH1A1
SCHEMBL31096344 0.74 KDM4E (0.42) GRM2ALDH1A1KDM4EPOLB
SCHEMBL24407574 0.74 KDM4E (0.42) GRM2ALDH1A1KDM4EPOLB
SCHEMBL30578895 0.69 PDE3B (0.33) —
SCHEMBL23853643 0.69 PDE3B (0.33) —
SCHEMBL25321271 0.69 TIPARP (0.33) HDAC1HDAC6MGLL
SCHEMBL27136921 0.68 STING1 (0.47) EGLN1GRM2LMNAKDM4ETNF

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3883553-A1 ARYL-ANILINE AND HETEROARYL-ANILINE COMPOUNDS FOR TREATMENT OF SKIN CANCERS NFlection Therapeutics, Inc. (US) 2021-09-29 — — EP disclosed
EP-3883567-A1 NAPHTHYRIDINONE-ANILINE COMPOUNDS FOR TREATMENT OF DERMAL DISORDERS NFlection Therapeutics, Inc. (US) 2021-09-29 — — EP disclosed
Send feedback