SCHEMBL17574338

SCHEMBL17574338

N=C(N/N=C/c1ccc(Cl)cc1)N/N=C/c1ccc(Cl)cc1F

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.46
NPC1 O15118 4/20 0.44
ATM Q13315 1/20 0.44
LMNA P02545 3/20 0.43
GUSB P08236 3/20 0.41
RAB9A P51151 3/20 0.41
CYP1A2 P05177 2/20 0.41
CYP3A4 P08684 2/20 0.41
CYP2C9 P11712 2/20 0.41
CYP2C19 P33261 2/20 0.41
NPSR1 Q6W5P4 1/20 0.41
MAPT P10636 5/20 0.41
CYP2D6 P10635 1/20 0.41
TDP1 Q9NUW8 1/20 0.40
FAAH O00519 1/20 0.40
KMT2A Q03164 2/20 0.39
MAPK1 P28482 1/20 0.39
MEN1 O00255 1/20 0.39
THRB P10828 1/20 0.39
KDM4E B2RXH2 2/20 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
Hydrochloric Acid SCHEMBL17560776 0.99 SMN1; SMN2 (0.45) SMN1; SMN2NPC1ATMLMNAGUSB
SCHEMBL17560756 0.93 LMNA (0.47) SMN1; SMN2NPC1LMNAGUSBRAB9A
SCHEMBL17560757 0.93 LMNA (0.47) SMN1; SMN2NPC1LMNAGUSBRAB9A
Hydrochloric Acid SCHEMBL19434705 0.91 LMNA (0.46) SMN1; SMN2NPC1LMNAGUSBRAB9A
SCHEMBL17574293 0.87 LMNA (0.44) SMN1; SMN2NPC1LMNARAB9ACYP1A2
Hydrochloric Acid SCHEMBL17560871 0.86 LMNA (0.43) SMN1; SMN2NPC1LMNARAB9ACYP1A2
SCHEMBL17574294 0.86 MAOB (0.51) SMN1; SMN2NPC1LMNAGUSBRAB9A
SCHEMBL16224323 0.86 LMNA (0.53) SMN1; SMN2NPC1ATMLMNAGUSB
SCHEMBL24278523 0.85 SMN1; SMN2 (0.40) SMN1; SMN2NPC1ATMLMNARAB9A
Hydrochloric Acid SCHEMBL17560978 0.85 MAOB (0.50) SMN1; SMN2NPC1LMNAGUSBRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11566012-B2 Methods for treating protozoan infections NEOCULI PTY LTD (AU) 2023-01-31 US disclosed
EP-3960729-A1 COMPOUNDS AND METHODS OF TREATING INFECTIONS Neoculi Pty Ltd (AU) 2022-03-02 EP disclosed
EP-2991968-B1 COMPOUNDS AND METHODS OF TREATING INFECTIONS NEOCULI PTY LTD (AU) 2021-11-10 EP disclosed
EP-3188722-B1 METHODS FOR TREATING PROTOZOAN INFECTIONS NEOCULI PTY LTD (AU) 2021-08-04 EP disclosed
US-20210009552-A1 METHODS FOR TREATING PROTOZOAN INFECTIONS NEOCULI PTY LTD (AU) 2021-01-14 US disclosed
US-10829468-B2 Methods for treating protozoan infections NEOCULI PTY LTD. (AU) 2020-11-10 US disclosed
US-20200290990-A1 METHODS FOR TREATING PROTOZOAN INFECTIONS NEOCULI PTY LTD (AU) 2020-09-17 US disclosed
US-10752606-B2 Methods for treating protozoan infections NEOCULI PTY LTD. (AU) 2020-08-25 US disclosed
US-20200102287-A1 METHODS FOR TREATING PROTOZOAN INFECTIONS NEOCULI PTY LTD (AU) 2020-04-02 US disclosed
US-10562880-B2 Methods for treating protozoan infections NEOCULI PTY LTD. (AU) 2020-02-18 US disclosed
US-20190330178-A1 METHODS FOR TREATING PROTOZOAN INFECTIONS NEOCULI PTY LTD (AU) 2019-10-31 US disclosed
US-10392363-B2 Methods for treating protozoan infections NEOCULI PTY LTD. (AU) 2019-08-27 US disclosed
US-10370341-B2 Compounds and methods of treating infections NEOCULI PTY LTD (AU) 2019-08-06 US disclosed
US-10253002-B2 Compounds and methods of treating infections NEOCULI PTY LTD (AU) 2019-04-09 US disclosed
US-20190084941-A1 COMPOUNDS AND METHODS OF TREATING INFECTIONS NEOCULI PTY LTD (AU) 2019-03-21 US disclosed
US-20170291886-A1 METHODS FOR TREATING PROTOZOAN INFECTIONS NEOCULI PTY LTD (AU) 2017-10-12 US disclosed
WO-2016033635-A1 METHODS FOR TREATING PROTOZOAN INFECTIONS NEOCULI PTY LTD (AU) 2016-03-10 WO 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 (13 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-20190084941-A1 COMPOUNDS AND METHODS OF TREATING INFECTIONS ELANE, IL1A, IL1B SMN1; SMN2 3440/4885NPC1 813/4885ATM 3995/4885
US-11566012-B2 Methods for treating protozoan infections DPM1, ABCB11, PIGS SMN1; SMN2 3002/4885NPC1 282/4885ATM 4811/4885
US-20200290990-A1 METHODS FOR TREATING PROTOZOAN INFECTIONS DPM1, ABCB11, PIGS SMN1; SMN2 3002/4885NPC1 282/4885ATM 4811/4885
US-10370341-B2 Compounds and methods of treating infections ELANE, IL1A, IL1B SMN1; SMN2 3440/4885NPC1 813/4885ATM 3995/4885
US-20210009552-A1 METHODS FOR TREATING PROTOZOAN INFECTIONS DPM1, ABCB11, PIGS SMN1; SMN2 3002/4885NPC1 282/4885ATM 4811/4885
US-20170291886-A1 METHODS FOR TREATING PROTOZOAN INFECTIONS DPM1, ABCB11, PIGS SMN1; SMN2 3002/4885NPC1 282/4885ATM 4811/4885
US-20200102287-A1 METHODS FOR TREATING PROTOZOAN INFECTIONS DPM1, ABCB11, PIGS SMN1; SMN2 3002/4885NPC1 282/4885ATM 4811/4885
US-20190330178-A1 METHODS FOR TREATING PROTOZOAN INFECTIONS DPM1, ABCB11, PIGS SMN1; SMN2 3002/4885NPC1 282/4885ATM 4811/4885
US-10829468-B2 Methods for treating protozoan infections DPM1, ABCB11, PIGS SMN1; SMN2 3002/4885NPC1 282/4885ATM 4811/4885
US-10562880-B2 Methods for treating protozoan infections DPM1, ABCB11, PIGS SMN1; SMN2 3002/4885NPC1 282/4885ATM 4811/4885
US-10752606-B2 Methods for treating protozoan infections DPM1, ABCB11, PIGS SMN1; SMN2 3002/4885NPC1 282/4885ATM 4811/4885
US-10392363-B2 Methods for treating protozoan infections DPM1, ABCB11, PIGS SMN1; SMN2 3002/4885NPC1 282/4885ATM 4811/4885
US-10253002-B2 Compounds and methods of treating infections ELANE, IL1A, IL1B SMN1; SMN2 3440/4885NPC1 813/4885ATM 3995/4885

“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.