SCHEMBL21167118

SCHEMBL21167118

O=c1c2cc3c(cc2n(Cc2ccccc2)c2cc(-c4ccccc4)cc(-c4ccccc4)c12)c(=O)c1c(-c2ccccc2)cc(-c2ccccc2)cc1n3Cc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ P2RX4 Q99571 1/20 0.48
▸ SRC P12931 3/20 0.43
▸ CYP19A1 P11511 1/20 0.41
▸ PIM1 P11309 1/20 0.41
▸ PIM2 Q9P1W9 1/20 0.41
▸ NTRK1 P04629 1/20 0.41
▸ SMN1; SMN2 Q16637 3/20 0.41
▸ ALDH1A1 P00352 3/20 0.41
▸ LMNA P02545 2/20 0.41
▸ RECQL P46063 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ ABCG2 Q9UNQ0 1/20 0.41
▸ PRKDC P78527 1/20 0.40
▸ CSNK2A2 P19784 1/20 0.40
▸ CSNK2B P67870 1/20 0.40
▸ CSNK2A1 P68400 1/20 0.40
▸ KMT2A Q03164 4/20 0.40
▸ PGR P06401 1/20 0.39
▸ MEN1 O00255 3/20 0.39
▸ MAPK1 P28482 1/20 0.39

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
SCHEMBL21167113 0.85 ALDH1A1 (0.44) PIM1ALDH1A1ABCG2KDM4EPOLB
SCHEMBL21167124 0.77 HSD17B10 (0.45) ALDH1A1RAB9AABCG2KDM4EMAPT
SCHEMBL21167114 0.76 ATM (0.37) SRCALDH1A1LMNAKMT2AMEN1
SCHEMBL21023182 0.74 P2RX4 (0.53) P2RX4SRCCYP19A1PIM1PIM2
SCHEMBL21167120 0.74 CDC25A (0.49) PIM1PIM2SMN1; SMN2LMNARAB9A
SCHEMBL28041337 0.73 P2RX4 (0.86) P2RX4SRCCYP19A1NTRK1SMN1; SMN2
SCHEMBL22499379 0.69 CYP19A1 (0.56) P2RX4SRCCYP19A1SMN1; SMN2ALDH1A1
SCHEMBL27901718 0.68 CYP19A1 (0.53) P2RX4SRCCYP19A1NTRK1SMN1; SMN2
SCHEMBL21167128 0.67 NTRK1 (0.36) PIM1NTRK1ALDH1A1KDM4EL3MBTL1
SCHEMBL263566 0.67 ABCG2 (0.79) P2RX4CYP19A1PIM1PIM2NTRK1

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
US-20190221745-A1 PHOTOELECTRIC CONVERSION ELEMENT, IMAGING ELEMENT, OPTICAL SENSOR, AND COMPOUND FUJIFILM CORPORATION (JP) 2019-07-18 — — US disclosed
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