SCHEMBL9675635

SCHEMBL9675635

ClCc1nc2cc(Br)ccc2s1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 1/20 0.47
DYRK1A Q13627 1/20 0.45
TRPV1 Q8NER1 2/20 0.44
AKR1B1 P15121 3/20 0.43
GAA P10253 2/20 0.42
MGAM O43451 1/20 0.42
SI P14410 1/20 0.42
MGAM2 Q2M2H8 1/20 0.42
PPARA Q07869 2/20 0.41
HDAC6 Q9UBN7 2/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
MAPK1 P28482 1/20 0.40
ADORA1 P30542 1/20 0.38
TUBB4A P04350 1/20 0.38
TUBB P07437 1/20 0.38
TUBA3C P0DPH7 1/20 0.38
TUBA1B P68363 1/20 0.38

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
SCHEMBL29081736 0.86 HDAC6 (0.46) LOXL2DYRK1ATRPV1AKR1B1GAA
SCHEMBL29184144 0.86 RAB9A (0.47) DYRK1AAKR1B1GAAPPARANPC1
SCHEMBL201370 0.84 DYRK1A (0.46) LOXL2DYRK1ATRPV1AKR1B1GAA
SCHEMBL31003151 0.82 NPC1 (0.63) LOXL2DYRK1ATRPV1AKR1B1GAA
SCHEMBL2947099 0.82 NPC1 (0.63) LOXL2DYRK1ATRPV1AKR1B1GAA
SCHEMBL3247063 0.82 LOXL2 (0.65) LOXL2DYRK1ATRPV1AKR1B1GAA
Hydrochloric Acid SCHEMBL29456890 0.81 LOXL2 (0.63) LOXL2DYRK1ATRPV1AKR1B1GAA
SCHEMBL27281641 0.81 DYRK1A (0.44) LOXL2DYRK1ATRPV1AKR1B1GAA
Hydrochloric Acid SCHEMBL20511957 0.81 LOXL2 (0.63) LOXL2DYRK1ATRPV1AKR1B1GAA
Iodide SCHEMBL31511840 0.81 LOXL2 (0.63) LOXL2DYRK1ATRPV1AKR1B1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0222576-B1 HETEROCYCLIC OXOPHTHALAZINYL ACETIC ACIDS PFIZER INC. (US) 1992-03-18 EP disclosed
CN-1009831-B PROCESS FOR PREPARING HETEROCYCLE-OXO-2,3-DIAZANAPHTHYL-ACETIC ACID PFIZER (US) 1990-10-03 CN disclosed
US-4748280-A Certain chlorination process for preparing 2-chloro-1,1,1-(C1 -C6) PFIZER INC. (US) 1988-05-31 US disclosed
US-4723010-A Process for preparing chloromethyl thiazoles or oxazoles, and intermediates for use therein PFIZER INC. (US) 1988-02-02 US disclosed
CN-86108308-A Heterocycle oxo-2 guanidine-acetic acid 1987-07-15 CN disclosed
EP-0222576-A2 Heterocyclic oxophthalazinyl acetic acids PFIZER INC. (US) 1987-05-20 EP disclosed