SCHEMBL24706384

SCHEMBL24706384

N#CC(C#N)=NNc1nc2ccc(Br)cc2s1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 3/20 0.52
▸ CYP2C19 P33261 3/20 0.52
▸ NPC1 O15118 2/20 0.52
▸ DYRK1A Q13627 2/20 0.52
▸ CYP1A2 P05177 2/20 0.52
▸ CYP3A4 P08684 2/20 0.52
▸ CYP2C9 P11712 2/20 0.52
▸ ALDH1A1 P00352 3/20 0.43
▸ CLK1 P49759 2/20 0.43
▸ TP53 P04637 1/20 0.43
▸ HPGD P15428 1/20 0.43
▸ MAPT P10636 5/20 0.41
▸ HTT P42858 1/20 0.41
▸ MEN1 O00255 3/20 0.41
▸ KMT2A Q03164 3/20 0.41
▸ GAA P10253 2/20 0.41
▸ HSP90AA1 P07900 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ POLB P06746 1/20 0.40

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
SCHEMBL24705955 0.89 DYRK1A (0.52) RAB9ACYP2C19NPC1DYRK1ACYP1A2
SCHEMBL24705959 0.84 DYRK1A (0.53) RAB9ANPC1DYRK1AALDH1A1TP53
SCHEMBL24707000 0.84 MAPT (0.55) RAB9ACYP2C19NPC1DYRK1ACYP1A2
SCHEMBL24707315 0.84 SMN1; SMN2 (0.55) RAB9ANPC1DYRK1ACYP3A4ALDH1A1
SCHEMBL24707370 0.81 DYRK1A (0.55) DYRK1ACYP2D6LRRK2
SCHEMBL923102 0.81 NPC1 (0.56) RAB9ACYP2C19NPC1DYRK1ACYP1A2
SCHEMBL24706996 0.81 PIK3CG (0.55) DYRK1AHSP90AA1
SCHEMBL922531 0.80 HSP90AA1 (0.57) RAB9ANPC1DYRK1ACYP1A2CYP3A4
SCHEMBL24706983 0.78 GAA (0.44) RAB9ACYP2C19NPC1DYRK1ACYP1A2
SCHEMBL24707371 0.78 MAPT (0.51) RAB9ANPC1ALDH1A1TP53HPGD

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-20220396553-A1 NOVEL HYDRAZONE DERIVATIVE IN WHICH TERMINAL AMINE GROUP IS SUBSTITUTED WITH ARYL GROUP OR HETEROARYL GROUP, AND USE THEREOF KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2022-12-15 — — US 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 (1 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-20220396553-A1 NOVEL HYDRAZONE DERIVATIVE IN WHICH TERMINAL AMINE GROUP IS SUBSTITUTED WITH ARYL GROUP OR HETEROARYL GROUP, AND USE THEREOF AANAT, NAT1, HNMT RAB9A 2732/4885CYP2C19 444/4885NPC1 3755/4885

“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.

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